SCHEMBL213934

SCHEMBL213934

Cn1cnc2n[c]nc-2c1

nearest known ligand 0.37

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
CYP2C9 P11712 2/20 0.37
CYP2C19 P33261 2/20 0.37
CYP2E1 P05181 1/20 0.37
CYP2A6 P11509 1/20 0.37
CYP2B6 P20813 1/20 0.37
TSHR P16473 1/20 0.34
MTOR P42345 1/20 0.34
HRH4 Q9H3N8 1/20 0.34
HRH3 Q9Y5N1 1/20 0.34
KDM2B Q8NHM5 1/20 0.34
PHF8 Q9UPP1 1/20 0.34
KDM5A P29375 1/20 0.33
KDM5B Q9UGL1 1/20 0.33
TDP1 Q9NUW8 1/20 0.33
LRRK2 Q5S007 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
SCHEMBL145693 0.70 CYP2C9 (0.39) CYP2C9CYP2C19CYP2E1CYP2A6CYP2B6
SCHEMBL18806853 0.66 CYP2C9 (0.57) CYP2C9CYP2C19CYP2E1CYP2A6CYP2B6
SCHEMBL16547507 0.65 CYP2C9 (0.52) CYP2C9CYP2C19CYP2E1CYP2A6CYP2B6
SCHEMBL26098599 0.62 CYP2C9 (0.41) CYP2C9CYP2C19CYP2E1CYP2A6CYP2B6
SCHEMBL1998996 0.62 KDM2B (0.34) CYP2C9CYP2C19CYP2E1CYP2A6CYP2B6
SCHEMBL746841 0.61 CYP2C9 (0.51) CYP2C9CYP2C19CYP2E1CYP2A6CYP2B6
SCHEMBL2216411 0.60 CYP2C9 (0.39) CYP2C9CYP2C19CYP2E1CYP2A6CYP2B6
SCHEMBL16096280 0.60 CYP2C9 (0.46) CYP2C9CYP2C19CYP2E1CYP2A6CYP2B6
SCHEMBL12075160 0.60 CYP2C9 (0.50) CYP2C9CYP2C19CYP2E1CYP2A6CYP2B6
SCHEMBL27927790 0.60 CYP2C9 (0.50) CYP2C9CYP2C19CYP2E1CYP2A6CYP2B6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10550203-B2 Polymers functionalized with heterocyclic nitrile compounds BRIDGESTONE CORPORATION (JP) 2020-02-04 US claimed
US-20180319905-A1 POLYMERS FUNCTIONALIZED WITH HETEROCYCLIC NITRILE COMPOUNDS BRIDGESTONE CORPORATION (JP) 2018-11-08 US claimed
US-20170015760-A1 POLYMERS FUNCTIONALIZED WITH HETEROCYCLIC NITRILE COMPOUNDS BRIDGESTONE CORPORATION (JP) 2017-01-19 US claimed
US-9469741-B2 Polymers functionalized with heterocyclic nitrile compounds BRIDGESTONE CORPORATION (JP) 2016-10-18 US claimed
US-9249244-B2 Process for producing polydienes BRIDGESTONE CORPORATION (JP) 2016-02-02 US claimed
EP-2969593-A1 POLYMERS FUNCTIONALIZED WITH HETEROCYCLIC IMINES Bridgestone Corporation (JP) 2016-01-20 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
WO-2014149931-A1 POLYMERS FUNCTIONALIZED WITH HETEROCYCLIC IMINES BRIDGESTONE CORPORATION (JP) 2014-09-25 WO 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
US-7671138-B2 Polymers functionized with hydrobenzamides BRIDGESTONE CORPORATION (JP) 2010-03-02 US claimed
WO-2009051702-A1 POLYMERS FUNCTIONALIZED WITH HETEROCYCLIC NITRILE COMPOUNDS BRIDGESTONE CORPORATION (JP) 2009-04-23 WO claimed
WO-2009051700-A1 POLYMERS FUNCTIONALIZED WITH HETEROCYCLIC NITRILE COMPOUNDS BRIDGESTONE CORPORATION (US) 2009-04-23 WO claimed
US-20090099325-A1 POLYMERS FUNCTIONALIZED WITH HETEROCYCLIC NITRILE COMPOUNDS BRIDGESTONE CORPORATION 2009-04-16 US claimed
US-20070276122-A1 Polymers functionalized with hydrobenzamides BRIDGESTONE CORPORATION 2007-11-29 US claimed
US-20070276098-A1 Polymers functionalized with hydrobenzamide BRIDGESTONE CORPORATION 2007-11-29 US claimed