SCHEMBL670662

SCHEMBL670662

CC(C)(O)C(C)(C)OB(O)C1CCC1

nearest known ligand 0.00

⚠ Novel chemotype — no close known analogue (best Tanimoto < 0.3). Unexplored chemical space relative to ChEMBL.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL16498878 0.94
SCHEMBL118435 0.91
SCHEMBL16991930 0.82
SCHEMBL194317 0.66 THRB (0.30)
SCHEMBL29219385 0.66
SCHEMBL16432080 0.65
SCHEMBL18398447 0.64
SCHEMBL2750776 0.64
SCHEMBL29219435 0.64 PDK1 (0.31)
SCHEMBL28364385 0.64 PDK1 (0.31)

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 17 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-119998274-A ULK inhibitors 微境生物医药科技(上海)有限公司 2025-05-13 CN disclosed
CN-118184657-A PARP7 inhibitor and preparation method and application thereof 成都先导药物开发股份有限公司 2024-06-14 CN disclosed
WO-2024109788-A1 PARP7 INHIBITOR, PREPARATION METHOD THEREFOR, AND USE THEREOF 成都先导药物开发股份有限公司 2024-05-30 WO disclosed
WO-2024099225-A1 ULK INHIBITORS 微境生物医药科技(上海)有限公司 2024-05-16 WO disclosed
CN-114716477-A 7-substituted phosphoryl quinazoline derivative and preparation method and application thereof 武汉人福创新药物研发中心有限公司 2022-07-08 CN disclosed
US-11352338-B2 Substituted isoindolinones BIOTHERYX, INC. (US) 2022-06-07 US disclosed
EP-3880669-A1 SUBSTITUTED ISOINDOLINONES Biotheryx, Inc. (US) 2021-09-22 EP disclosed
CN-113423701-A Substituted isoindolinones 拜欧斯瑞克斯公司 2021-09-21 CN disclosed
US-10844039-B2 Substituted isoindolinones BIOTHERYX, INC. (US) 2020-11-24 US disclosed
US-20200325114-A1 SUBSTITUTED ISOINDOLINONES BIOTHERYX, INC. (US) 2020-10-15 US disclosed
WO-2020102195-A1 SUBSTITUTED ISOINDOLINONES BIOTHERYX, INC. (US) 2020-05-22 WO disclosed
US-20200148663-A1 SUBSTITUTED ISOINDOLINONES BIOTHERYX, INC. 2020-05-14 US disclosed
EP-2605658-B1 SPIROXAZOLIDINONE COMPOUNDS MERCK SHARP & DOHME (US) 2016-03-23 EP disclosed
US-8742110-B2 Spiroxazolidinone compounds MERCK SHARP & DOHME CORP. (US) 2014-06-03 US disclosed
EP-2605658-A1 SPIROXAZOLIDINONE COMPOUNDS Merck Sharp & Dohme Corp. (US) 2013-06-26 EP disclosed
US-20130131042-A1 SPIROXAZOLIDINONE COMPOUNDS MERCK SHARP & DOHME CORP. (US) 2013-05-23 US disclosed
WO-2012024183-A1 SPIROXAZOLIDINONE COMPOUNDS MERCK SHARP & DOHME CORP. (US) 2012-02-23 WO disclosed