SCHEMBL2858599

SCHEMBL2858599

CCCCCc1ccccc1Oc1c(O)cccc1O

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 1/20 0.56
PTGS2 P35354 1/20 0.56
BID P55957 3/20 0.50
MCL1 Q07820 3/20 0.50
PPARA Q07869 3/20 0.50
BCL2L1 Q07817 2/20 0.50
BAK1 Q16611 2/20 0.50
KAT8 Q9H7Z6 2/20 0.50
PPARG P37231 2/20 0.50
SAE1 Q9UBE0 2/20 0.50
EP300 Q09472 1/20 0.50
KAT2A Q92830 1/20 0.50
KAT2B Q92831 1/20 0.50
KAT5 Q92993 1/20 0.50
THRA P10827 1/20 0.49
THRB P10828 1/20 0.49
LIPG Q9Y5X9 1/20 0.46
MMP2 P08253 2/20 0.44
F7 P08709 2/20 0.44
F3 P13726 2/20 0.44

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
SCHEMBL2857405 0.98 ALOX5 (0.55) ALOX5PTGS2BIDMCL1PPARA
SCHEMBL2860914 0.95 ALOX5 (0.50) ALOX5PTGS2BIDMCL1PPARA
SCHEMBL27963757 0.94 ALOX5 (0.54) ALOX5PTGS2BIDMCL1PPARA
SCHEMBL27963754 0.94 ALOX5 (0.54) ALOX5PTGS2BIDMCL1PPARA
SCHEMBL1840649 0.94 ALOX5 (0.54) ALOX5PTGS2BIDMCL1PPARA
SCHEMBL27963727 0.94 ALOX5 (0.54) ALOX5PTGS2BIDMCL1PPARA
SCHEMBL27963725 0.94 ALOX5 (0.54) ALOX5PTGS2BIDMCL1PPARA
SCHEMBL1841069 0.93 ALOX5 (0.52) ALOX5PTGS2BIDMCL1PPARA
SCHEMBL1840304 0.93 ALOX5 (0.52) ALOX5PTGS2BIDMCL1PPARA
SCHEMBL1834409 0.93 ALOX5 (0.52) ALOX5PTGS2BIDMCL1PPARA

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 4 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
CN-100364160-C Polymer electrolyte material, polymer electrolyte part, membrane electrode composite and polymer electrolyte type fuel cell TORAY INDUSTRIES (JP) 2008-01-23 CN 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