SCHEMBL2689528

SCHEMBL2689528

CCCC1CC(=O)C1

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
SCHEMBL1177039 0.90 MAPT (0.47)
SCHEMBL2691102 0.84
SCHEMBL2691445 0.82 CYP1A2 (0.55)
SCHEMBL11854232 0.82 MAPT (0.32)
SCHEMBL3383889 0.82 NOS3 (0.34)
SCHEMBL19976638 0.80 CYP1A2 (0.53)
SCHEMBL6438527 0.80
SCHEMBL2690432 0.80
SCHEMBL6437615 0.80
SCHEMBL2690939 0.80 CYP1A2 (0.53)

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 27 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-114751849-B Preparation method of brivaracetam and intermediate compound 四川奥邦古得药业有限公司 2024-03-22 CN claimed
CN-114480315-B Baeyer-Villiger monooxygenase and application thereof in brivaracetam synthesis 四川奥邦古得药业有限公司 2023-09-19 CN claimed
CN-114751849-A Preparation method of brivaracetam and intermediate compound 成都栩哲医药科技有限公司 2022-07-15 CN claimed
CN-114480315-A Baeyer-Villiger monooxygenase and application thereof in brivaracetam synthesis 成都栩哲医药科技有限公司 2022-05-13 CN claimed
CN-114751849-B Preparation method of brivaracetam and intermediate compound 四川奥邦古得药业有限公司 2024-03-22 CN disclosed
CN-114751849-B Preparation method of brivaracetam and intermediate compound 四川奥邦古得药业有限公司 2024-03-22 CN disclosed
EP-4318629-A1 PRIMER FOR POWER STORAGE DEVICE ELECTRODES, COMPOSITION FOR FORMING PRIMER LAYER, ELECTRODE FOR POWER STORAGE DEVICES, AND SECONDARY BATTERY AGC INC. (JP) 2024-02-07 EP disclosed
US-20230420686-A1 PRIMER FOR POWER STORAGE DEVICE ELECTRODE, COMPOSITION FOR FORMING PRIMER LAYER, ELECTRODE FOR POWER STORAGE DEVICE, AND SECONDARY BATTERY AGC Inc. (JP) 2023-12-28 US disclosed
CN-114480315-B Baeyer-Villiger monooxygenase and application thereof in brivaracetam synthesis 四川奥邦古得药业有限公司 2023-09-19 CN disclosed
CN-115960750-A Baeyer-Villiger monooxygenase, mutant and application thereof in preparation of chiral butyrolactone 华东理工大学 2023-04-14 CN disclosed
CN-114751849-A Preparation method of brivaracetam and intermediate compound 成都栩哲医药科技有限公司 2022-07-15 CN disclosed
CN-114751849-A Preparation method of brivaracetam and intermediate compound 成都栩哲医药科技有限公司 2022-07-15 CN disclosed
US-7691456-B2 Spiro[3.3] heptyl-dioxan derivatives and their use in liquid crystal media MERCK PATENT GESELLSCHAFT (DE) 2010-04-06 US disclosed
US-20080251761-A1 Spiro[3.3] Heptyl-Dioxan Derivatives and Their Use in Liquid Crystal Media MERCK PATENT GESELLSCHAFT (DE) 2008-10-16 US disclosed
US-20080251761-A1 Spiro[3.3] Heptyl-Dioxan Derivatives and Their Use in Liquid Crystal Media MERCK PATENT GESELLSCHAFT (DE) 2008-10-16 US disclosed
WO-2007045382-A1 SPIRO [3.3] HEPTYL-DIOXAN DERIVATIVES AND THEIR USE IN LIQUID CRYSTAL MEDIA MERCK PATENT GMBH (DE) 2007-04-26 WO disclosed
EP-1453913-A4 NOVEL SUBSTITUTED ALKANE COMPOUNDS AND USES THEREOF ANTEX PHARMA INC (US) 2006-04-05 EP disclosed
US-20050148570-A1 Novel substituted alkane compounds and uses thereof HUANG LIREN (US) 2005-07-07 US disclosed
EP-1453913-A2 NOVEL SUBSTITUTED ALKANE COMPOUNDS AND USES THEREOF Antex Pharma, Inc. (US) 2004-09-08 EP disclosed
WO-2003062443-A2 NOVEL SUBSTITUTED ALKANE COMPOUNDS AND USES THEREOF ANTEX PHARMA, INC. (US) 2003-07-31 WO disclosed