SCHEMBL1102380

SCHEMBL1102380

CCCCCCc1cc(C)sc1-c1cc2c(CCCCCC)c3sc(-c4sc(C)cc4CCCCCC)cc3c(CCCCCC)c2s1

nearest known ligand 0.34

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
GPR35 Q9HC97 6/20 0.34
ALOX5 P09917 5/20 0.33
TYR P14679 2/20 0.33
MEN1 O00255 1/20 0.33
TP53 P04637 1/20 0.33
CYP3A4 P08684 1/20 0.33
MAPT P10636 1/20 0.33
ALOX15 P16050 1/20 0.33
TSHR P16473 1/20 0.33
HTT P42858 1/20 0.33
KMT2A Q03164 1/20 0.33
TDP1 Q9NUW8 1/20 0.33
LIPG Q9Y5X9 1/20 0.30
PTGS2 P35354 3/20 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
SCHEMBL1102379 1.00 GPR35 (0.34) GPR35ALOX5TYRMEN1TP53
SCHEMBL1102386 0.97 GPR35 (0.33) GPR35ALOX5TYRMEN1TP53
SCHEMBL12857932 0.94 GPR35 (0.33) GPR35ALOX5TYRMEN1TP53
SCHEMBL12857934 0.89 TYR (0.35) GPR35ALOX5TYRMEN1TP53
SCHEMBL1102381 0.87 GPR35 (0.33) GPR35ALOX5PTGS2
SCHEMBL1102384 0.86 TYR (0.34) GPR35ALOX5TYRMEN1TP53
SCHEMBL1102389 0.86 GPR35 (0.33) GPR35ALOX5TYRMEN1TP53
SCHEMBL14997964 0.86 GPR35 (0.30) GPR35
SCHEMBL1102390 0.84 TYMP (0.33) GPR35PTGS2
SCHEMBL19295440 0.84 GPR35 (0.33) GPR35ALOX5TYRMEN1TP53

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20140251407-A1 THERMOELECTRIC CONVERSION MATERIAL AND A THERMOELECTRIC CONVERSION ELEMENT FUJIFILM CORPORATION (JP) 2014-09-11 US disclosed
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-20080103286-A1 Poly(dithienylbenzo[1,2-B:4,5-B']dithiophene) polymers XEROX CORPORATION 2008-05-01 US disclosed
US-20080102559-A1 Electronic devices XEROX CORPORATION 2008-05-01 US disclosed