Navigating around Patented Routes by Preserving Specific Motifs along Computer-Planned Retrosynthetic Pathways

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Title
Navigating around Patented Routes by Preserving Specific Motifs along Computer-Planned Retrosynthetic Pathways
Author(s)
Karol Molga; Piotr Dittwald; Bartosz A. Grzybowski
Publication Date
2019-02
Journal
CHEM, v.5, no.2, pp.460 - 473
Publisher
Cell Press
Abstract
By keeping track of lists of specific bonds one wishes to preserve, a computer program is able to identify the key disconnections used in the patented syntheses and design synthetic routes that circumvent these approaches. Here, we provide examples of computer-designed syntheses relevant to medicinal chemistry, in which the machine avoids "strategic" disconnections common to industrial patents and is forced to use different starting materials. The ability of modern retrosynthetic planners to navigate around patented solutions may have significant implications for the ways in which intellectual property related to multistep syntheses is protected and/or challenged. (c) 2018 Published by Elsevier
URI
https://pr.ibs.re.kr/handle/8788114/5696
ISSN
2451-9294
Appears in Collections:
Center for Soft and Living Matter(첨단연성물질 연구단) > Journal Papers (저널논문)
Files in This Item:
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