SCHEMBL2860918

SCHEMBL2860918

CCCCc1c(O)cccc1OOc1ccccc1

nearest known ligand 0.43

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
CNR1 P21554 6/20 0.41
CNR2 P34972 6/20 0.41
ALOX5 P09917 1/20 0.38
PTGS2 P35354 1/20 0.38
NPC1 O15118 1/20 0.38
HPGD P15428 1/20 0.38
MAPK1 P28482 1/20 0.38
HTT P42858 1/20 0.38
RAB9A P51151 1/20 0.38
NPSR1 Q6W5P4 1/20 0.38
LTA4H P09960 1/20 0.37
SLC37A4 O43826 1/20 0.36
BID P55957 3/20 0.36
MCL1 Q07820 3/20 0.36
BCL2L1 Q07817 2/20 0.36
BAK1 Q16611 2/20 0.36

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
SCHEMBL2858604 0.95 CNR1 (0.46) CNR1CNR2ALOX5PTGS2BID
SCHEMBL2857412 0.94 CNR1 (0.47) CNR1CNR2ALOX5PTGS2BID
SCHEMBL2867830 0.91 TP53 (0.36) CNR1CNR2HPGDMAPK1
SCHEMBL2856387 0.84 TP53 (0.38) HPGDMAPK1NPSR1
SCHEMBL2867966 0.82 LTA4H (0.47) CNR1HPGDMAPK1HTTLTA4H
SCHEMBL59744 0.79 ALOX5 (0.54) CNR1CNR2ALOX5PTGS2NPC1
SCHEMBL31327375 0.79 ALOX5 (0.54) CNR1CNR2ALOX5PTGS2NPC1
Benzene SCHEMBL28002837 0.78 HTT (0.57) NPC1HPGDMAPK1HTTRAB9A
SCHEMBL5206937 0.78 DPP4 (0.44) NPSR1
SCHEMBL25382247 0.78 CNR1 (0.50) CNR1CNR2ALOX5PTGS2NPC1

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