SCHEMBL2879321

SCHEMBL2879321

CCCc1cccc(-c2cc(O)ccc2O)c1CCC

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CNR1 P21554 1/20 0.46
CNR2 P34972 1/20 0.46
ALOX5 P09917 3/20 0.41
TYR P14679 3/20 0.40
ANPEP P15144 1/20 0.39
DPP4 P27487 1/20 0.39
MEN1 O00255 1/20 0.38
TP53 P04637 1/20 0.38
CYP3A4 P08684 1/20 0.38
MAPT P10636 1/20 0.38
ALOX15 P16050 1/20 0.38
TSHR P16473 1/20 0.38
HTT P42858 1/20 0.38
KMT2A Q03164 1/20 0.38
TDP1 Q9NUW8 1/20 0.38
ESR1 P03372 5/20 0.38
ESR2 Q92731 5/20 0.38
ELANE P08246 1/20 0.38
CTSG P08311 1/20 0.38
HSD17B3 P37058 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
SCHEMBL2863894 0.88 TYR (0.53) CNR1CNR2ALOX5TYRANPEP
SCHEMBL984433 0.83 ELANE (0.44) CNR1CNR2ALOX5ELANECTSG
SCHEMBL8674511 0.81 ELANE (0.38) ALOX5TSHRELANECTSGGABRA1
SCHEMBL2866344 0.81 ANPEP (0.48) CNR1CNR2TYRANPEPDPP4
SCHEMBL5589182 0.79 ELANE (0.47) ELANECTSGGABRA1GABRB2JUN
SCHEMBL2860944 0.76 MAOB (0.42) ALOX5TYRMEN1TP53CYP3A4
SCHEMBL4527020 0.76 KDM4E (0.38) ELANECTSGGABRA1GABRB2
SCHEMBL8926002 0.75 ANPEP (0.47) CNR1CNR2ALOX5TYRANPEP
SCHEMBL2858607 0.75 MAPT (0.46) ALOX5TYRMEN1TP53CYP3A4
SCHEMBL218408 0.74 IAPP (0.44) ELANECTSGGABRA1GABRB2

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