SCHEMBL1102390

SCHEMBL1102390

CCCCCCCCCCCCCCCCc1c2cc(-c3sc(C)cc3Cl)sc2c(CCCCCCCCCCCCCCCC)c2cc(-c3sc(C)cc3Cl)sc12

nearest known ligand 0.33

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
TYMP P19971 3/20 0.33
PTGS2 P35354 2/20 0.32
GPR35 Q9HC97 5/20 0.32
CFTR P13569 1/20 0.30

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
SCHEMBL1102381 0.86 GPR35 (0.33) PTGS2GPR35
SCHEMBL1102379 0.84 GPR35 (0.34) PTGS2GPR35
SCHEMBL1102380 0.84 GPR35 (0.34) PTGS2GPR35
SCHEMBL1102386 0.82 GPR35 (0.33) GPR35
SCHEMBL12857932 0.80 GPR35 (0.33) GPR35
SCHEMBL13641593 0.78 GPR35 (0.39) PTGS2GPR35
SCHEMBL15440853 0.78 GPR35 (0.39) PTGS2GPR35
SCHEMBL11928956 0.78 GPR35 (0.39) PTGS2GPR35
SCHEMBL25450785 0.77 GPR35 (0.35) PTGS2GPR35
SCHEMBL1102389 0.77 GPR35 (0.33) TYMPGPR35

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 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8153755-B2 Electronic devices XEROX CORPORATION (US) 2012-04-10 US disclosed
US-20110034668-A1 ELECTRONIC DEVICES XEROX CORPORATION (US) 2011-02-10 US disclosed
US-7834132-B2 Electronic devices XEROX CORPORATION (US) 2010-11-16 US disclosed
US-7820782-B2 Poly(dithienylbenzo[1,2-b:4,5-b′]dithiophene) polymers XEROX CORPORATION (US) 2010-10-26 US disclosed
US-20080102559-A1 Electronic devices XEROX CORPORATION 2008-05-01 US disclosed
US-20080103286-A1 Poly(dithienylbenzo[1,2-B:4,5-B']dithiophene) polymers XEROX CORPORATION 2008-05-01 US disclosed