SCHEMBL2860157

SCHEMBL2860157

Cc1cccc(-c2ccc(O)cc2O)c1C

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TRPA1 O75762 1/20 0.50
ATM Q13315 1/20 0.50
CNR1 P21554 1/20 0.49
CNR2 P34972 1/20 0.49
MGAM O43451 1/20 0.47
GAA P10253 1/20 0.47
SI P14410 1/20 0.47
MGAM2 Q2M2H8 1/20 0.47
ALOX5 P09917 3/20 0.46
ESR2 Q92731 4/20 0.46
ANPEP P15144 1/20 0.45
DPP4 P27487 1/20 0.45
CHEK1 O14757 1/20 0.44
WEE1 P30291 1/20 0.44
CYP1A2 P05177 1/20 0.43
CYP2C19 P33261 1/20 0.43
TLR8 Q9NR97 1/20 0.42
TYR P14679 1/20 0.42
KDM4E B2RXH2 1/20 0.41
LMNA P02545 1/20 0.41

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
SCHEMBL8373514 0.88 ESR2 (0.55) TRPA1ATMCNR1CNR2ESR2
SCHEMBL2864101 0.86 MGAM (0.49) TRPA1ATMCNR1CNR2MGAM
SCHEMBL28597257 0.84 ATM (0.45) TRPA1ATMCNR1CNR2MGAM
SCHEMBL5569934 0.84 GAA (0.49) TRPA1ATMMGAMGAASI
SCHEMBL5703467 0.84 GAA (0.49) TRPA1ATMMGAMGAASI
SCHEMBL2865467 0.83 ALOX5 (0.54) MGAMGAASIMGAM2ALOX5
SCHEMBL8039251 0.82 MGAM (0.46) MGAMGAASIMGAM2ALOX5
SCHEMBL982858 0.81 ATM (0.62) TRPA1ATMCNR1CNR2MGAM
SCHEMBL29362811 0.81 ATM (0.62) TRPA1ATMCNR1CNR2MGAM
SCHEMBL5688012 0.81 CASP1 (0.53) TRPA1ATMCNR1CNR2ANPEP

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