SCHEMBL274426

SCHEMBL274426

N#CCc1csc2ccccc12

nearest known ligand 0.60

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
CYP2A6 P11509 3/20 0.60
CHRNA7 P36544 1/20 0.47
SMN1; SMN2 Q16637 4/20 0.46
CRHBP P24387 1/20 0.46
CRHR2 Q13324 1/20 0.46
CA1 P00915 1/20 0.46
CA2 P00918 1/20 0.46
ALDH1A1 P00352 1/20 0.42
IDO1 P14902 1/20 0.41
TAAR1 Q96RJ0 1/20 0.41
CTSL P07711 1/20 0.41
CTSS P25774 1/20 0.41
CTSK P43235 1/20 0.41
JUN P05412 1/20 0.40
MAPK8 P45983 1/20 0.40
MAPK9 P45984 1/20 0.40
MAPT P10636 1/20 0.40

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
SCHEMBL31452756 1.00 CYP2A6 (0.60) CYP2A6CHRNA7SMN1; SMN2CRHBPCRHR2
SCHEMBL5764990 0.81 CYP2A6 (0.56) CYP2A6CHRNA7SMN1; SMN2CRHBPCRHR2
SCHEMBL6713803 0.81 CYP2A6 (0.60) CYP2A6CHRNA7SMN1; SMN2CRHBPCRHR2
SCHEMBL13046057 0.81 CYP2A6 (0.60) CYP2A6CHRNA7SMN1; SMN2CRHBPCRHR2
SCHEMBL5237450 0.79 CYP2A6 (0.53) CYP2A6CHRNA7SMN1; SMN2CRHBPCRHR2
SCHEMBL3672077 0.79 CYP2A6 (0.58) CYP2A6ALDH1A1MAPT
SCHEMBL2264338 0.76 CYP19A1 (0.43) CYP2A6ALDH1A1
SCHEMBL2248829 0.75 CYP2A6 (1.00) CYP2A6CHRNA7SMN1; SMN2CRHBPCRHR2
SCHEMBL7141321 0.75 CYP2A6 (0.67) CYP2A6SMN1; SMN2CA2MAPT
SCHEMBL8549384 0.75 CYP2A6 (0.67) CYP2A6CA2MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-113896709-B Synthetic method of benzothiophene-3-acetic acid 南京一苇医药科技有限公司 2023-02-28 CN claimed
CN-113896709-A Synthetic method of benzothiophene-3-acetic acid 南京一苇医药科技有限公司 2022-01-07 CN claimed
CN-106116998-B A kind of stereoselective syntheses (Z) -2,4- bis- replaces the method for -2- butylene nitrile compounds 华南理工大学 2018-06-19 CN claimed
CN-106116998-A A kind of method of stereoselective syntheses (Z) 2,4 two replacement 2 butene nitrile compounds 华南理工大学 2016-11-16 CN claimed
US-9469741-B2 Polymers functionalized with heterocyclic nitrile compounds BRIDGESTONE CORPORATION (JP) 2016-10-18 US claimed
EP-2203482-B1 POLYMERS FUNCTIONALIZED WITH HETEROCYCLIC NITRILE COMPOUNDS BRIDGESTONE CORP (JP) 2015-11-25 EP claimed
US-20150267031-A1 POLYMERS FUNCTIONALIZED WITH HETEROCYCLIC NITRILE COMPOUNDS BRIDGESTONE CORPORATION (JP) 2015-09-24 US claimed
US-9085646-B2 Polymers functionalized with heterocyclic nitrile compounds BRIDGESTONE CORPORATION (JP) 2015-07-21 US claimed
US-20130066016-A1 POLYMERS FUNCTIONALIZED WITH HETEROCYCLIC NITRILE COMPOUNDS BRIDGESTONE CORPORATION (JP) 2013-03-14 US claimed
US-8362156-B2 Polymers functionalized with heterocyclic nitrile compounds BRIDGESTONE CORPORATION (JP) 2013-01-29 US claimed
US-8314189-B2 Polymers functionalized with heterocyclic nitrile compounds BRIDGESTONE CORPORATION (JP) 2012-11-20 US claimed
US-20100280217-A1 POLYMERS FUNCTIONALIZED WITH HETEROCYCLIC NITRILE COMPOUNDS BRIDGESTONE CORPORATION (JP) 2010-11-04 US claimed
EP-2203482-A1 POLYMERS FUNCTIONALIZED WITH HETEROCYCLIC NITRILE COMPOUNDS Bridgestone Corporation (JP) 2010-07-07 EP claimed
WO-2009051700-A1 POLYMERS FUNCTIONALIZED WITH HETEROCYCLIC NITRILE COMPOUNDS BRIDGESTONE CORPORATION (US) 2009-04-23 WO claimed
WO-2009051702-A1 POLYMERS FUNCTIONALIZED WITH HETEROCYCLIC NITRILE COMPOUNDS BRIDGESTONE CORPORATION (JP) 2009-04-23 WO claimed
US-20090099325-A1 POLYMERS FUNCTIONALIZED WITH HETEROCYCLIC NITRILE COMPOUNDS BRIDGESTONE CORPORATION 2009-04-16 US claimed
JP-7053496-A None JP disclosed
WO-2026102105-A1 FUNCTIONAL POLYBUTADIENE AND CARBON BLACK IN RUBBER COMPOUNDS BRIDGESTONE AMERICAS TIRE OPERATIONS, LLC (US) 2026-05-15 WO disclosed
US-4238484-A O,O-DIALKYL-O-/3-BENZOTHIENGLYOXYLONITRILE OXIMO/PHOSPHATE ABBOTT LABORATORIES (US) 1980-12-09 US disclosed
WO-1980000563-A1 SUBSTITUTED ACETIC ACID ESTERS SOREX LTD (GB) 1980-04-03 WO disclosed