SCHEMBL2855431

SCHEMBL2855431

CCCc1cc(C(=O)c2ccccc2)c(O)c(CCC)c1O

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PPARG P37231 2/20 0.46
PPARA Q07869 2/20 0.46
BCL2 P10415 2/20 0.46
MCL1 Q07820 2/20 0.46
LDHA P00338 1/20 0.41
LDHB P07195 1/20 0.41
RXRA P19793 1/20 0.41
HSP90AB1 P08238 1/20 0.41
MEN1 O00255 1/20 0.41
USP2 O75604 1/20 0.41
GAA P10253 1/20 0.41
KMT2A Q03164 1/20 0.41
KEAP1 Q14145 1/20 0.41
NFE2L2 Q16236 1/20 0.41
KDM4E B2RXH2 2/20 0.40
MAPT P10636 2/20 0.40
MAPK1 P28482 2/20 0.40
HSD17B10 Q99714 2/20 0.40
ALOX15 P16050 1/20 0.40
CTSD P07339 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
SCHEMBL1446427 0.91 BCL2 (0.50) PPARGPPARABCL2MCL1LDHA
SCHEMBL2855392 0.89 BCL2 (0.43) BCL2MCL1MEN1USP2GAA
SCHEMBL29236376 0.88 BCL2 (0.49) PPARGPPARABCL2MCL1LDHA
SCHEMBL10560290 0.84 PPARG (0.43) PPARGPPARAHSP90AB1KMT2AALOX15
SCHEMBL2868258 0.84 HPGD (0.47) PPARGPPARABCL2MCL1LDHA
SCHEMBL2859228 0.84 HPGD (0.47) PPARGPPARABCL2MCL1RXRA
SCHEMBL2861278 0.83 BCL2 (0.53) BCL2MCL1MEN1USP2GAA
SCHEMBL29176068 0.80 BCL2 (0.43) BCL2MCL1MEN1USP2GAA
SCHEMBL2862125 0.79 MAPT (0.49) BCL2MCL1MEN1USP2GAA
SCHEMBL3089697 0.79 BCL2 (0.49) PPARGPPARABCL2MCL1HSP90AB1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7713449-B2 Polymer electrolytic material, polymer electrolytic part, membrane electrode assembly, and polymer electrolyte fuel cell TORAY INDUSTRIES, INC. (JP) 2010-05-11 US disclosed
US-20060180796-A1 Polymer electrolyte material, polymer electrolyte part, membrane electrode composite and polymer electrolyte type fuel cell TORAY INDUSTRIES, INC. (JP) 2006-08-17 US disclosed
EP-1619735-A1 POLYMER ELECTROLYTE MATERIAL, POLYMER ELECTROLYTE PART, MEMBRANE ELECTRODE COMPOSITE AND POLYMER ELECTROLYTE TYPE FUEL CELL TORAY INDUSTRIES, INC. (JP) 2006-01-25 EP disclosed