SCHEMBL8522382

SCHEMBL8522382

CC(C#N)C1CCCCC1

nearest known ligand 0.47

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
SHBG P04278 1/20 0.39
SLC6A3 Q01959 2/20 0.35
EPHX1 P07099 2/20 0.33
TSHR P16473 1/20 0.33
CA12 O43570 2/20 0.31
CA1 P00915 2/20 0.31
CA2 P00918 2/20 0.31
MMP2 P08253 2/20 0.31
CA9 Q16790 2/20 0.31
TP53 P04637 1/20 0.31

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

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
SCHEMBL1371349 0.97
Methylamine SCHEMBL27951566 0.92 EPHX1 (0.32) SHBGSLC6A3EPHX1TSHRTP53
SCHEMBL937062 0.92
SCHEMBL882385 0.86
Phosphoric Acid SCHEMBL15389186 0.84 MMP2 (0.42) EPHX1CA12CA1CA2MMP2
Sulfuric Acid SCHEMBL15389382 0.84 EPHX1 (0.34) EPHX1CA12CA1CA2MMP2
Bromide SCHEMBL29487599 0.83
SCHEMBL28773707 0.78 JAK2 (0.32)
SCHEMBL4840512 0.78 SHBG (0.42) SHBGEPHX1CA12CA1CA2
SCHEMBL2759860 0.77 TSHR (0.32) TSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-116096764-A Functionalized polymers 赢创运营有限公司 2023-05-09 CN claimed
CN-111356710-B Functionalized polymers 赢创运营有限公司 2022-04-26 CN claimed
CN-111356710-A Functionalized polymers 赢创运营有限公司 2020-06-30 CN claimed
CN-103254190-A Heteroaryl substituted pyrrolo[2,3-b]pyridines and pyrrolo[2,3-b]pyrimidines as janus kinase inhibitors INCYTE CORP 2013-08-21 CN claimed
CN-103214483-A Heteroaryl substituted pyrrolo[2,3-b]pyridines and pyrrolo[2,3-b]pyrimidines as janus kinase inhibitors INCYTE CORP 2013-07-24 CN claimed
CN-103214484-A Heteroaryl substituted pyrrolo[2,3-b]pyridines and pyrrolo[2,3-b]pyrimidines as janus kinase inhibitors INCYTE CORP A DELAWARE CORP 2013-07-24 CN claimed
CN-101448826-A Heteroaryl substituted pyrrolo [2 ] as janus kinase inhibitors INCYTE CORP (US) 2009-06-03 CN claimed
JP-60152440-A None JP disclosed
US-12032290-B2 Actinic ray-sensitive or radiation-sensitive resin composition, resist film, pattern forming method, and method for manufacturing electronic device FUJIFILM CORPORATION (JP) 2024-07-09 US disclosed
WO-2024074779-A1 METHOD FOR GRANULATING AZO COMPOUNDS, AND RESULTING GRANULES ARKEMA FRANCE (FR) 2024-04-11 WO disclosed
CN-116096764-A Functionalized polymers 赢创运营有限公司 2023-05-09 CN disclosed
CN-115121807-A Object manufacturing method 株式会社理光 2022-09-30 CN disclosed
CN-111356710-B Functionalized polymers 赢创运营有限公司 2022-04-26 CN disclosed
CN-1092649-C Thiazolidinone compound or angina pectoris therapeutic or prophylactic agent containing the same as active ingredient SANKYO CO (JP) 2002-10-16 CN disclosed
EP-0797569-B1 CYCLOHEX(EN)YL-PROPIONITRILES QUEST INT (NL) 1999-06-02 EP disclosed
CN-1175250-A Thiazolidinone compound or angina pectoris therapeutic or prophylactic agent containing the same as active ingredient SANKYO CO (JP) 1998-03-04 CN disclosed
EP-0797569-A1 CYCLOHEX(EN)YL-PROPIONITRILES QUEST INTERNATIONAL (NL) 1997-10-01 EP disclosed
WO-1996018604-A1 CYCLOHEX(EN)YL-PROPIONITRILES QUEST INTERNATIONAL (NL) 1996-06-20 WO disclosed
US-5382727-A Free radical chlorination of 1,1-dichloroethane PPG INDUSTRIES, INC. (US) 1995-01-17 US disclosed
JP-S60152440-A PRODUCTION OF DELTA-OXOCARBOXYLIC ACID AND ITS DERIVATIVE SUMITOMO CHEM CO LTD 1985-08-10 JP disclosed