SCHEMBL2866340

SCHEMBL2866340

CCc1ccccc1-c1cc(O)cc(CC)c1O

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GABRA1 P14867 2/20 0.48
GABRB2 P47870 2/20 0.48
PTPN5 P54829 1/20 0.43
CSNK2A2 P19784 1/20 0.42
CSNK2B P67870 1/20 0.42
CSNK2A1 P68400 1/20 0.42
CSNK2A3 Q8NEV1 1/20 0.42
ANPEP P15144 2/20 0.41
DPP4 P27487 2/20 0.41
CHEK1 O14757 1/20 0.40
WEE1 P30291 1/20 0.40
BCL2 P10415 1/20 0.38
MCL1 Q07820 1/20 0.38
DHFR P00374 1/20 0.37
TRPA1 O75762 1/20 0.36
CYP2D6 P10635 1/20 0.36
NPC1 O15118 1/20 0.35
ALDH1A1 P00352 1/20 0.35
LMNA P02545 1/20 0.35
MAPT P10636 1/20 0.35

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
SCHEMBL11414376 0.86 CHEK1 (0.47) GABRA1GABRB2PTPN5CSNK2A2CSNK2B
SCHEMBL2879316 0.84 PTPN1 (0.40) GABRA1GABRB2PTPN5
SCHEMBL10672625 0.82 ANPEP (0.50) GABRA1GABRB2CSNK2A2CSNK2BCSNK2A1
SCHEMBL2863887 0.81 ALOX5 (0.46) CYP2D6MAPT
SCHEMBL8926002 0.79 ANPEP (0.47) GABRA1GABRB2CSNK2A2CSNK2BCSNK2A1
SCHEMBL29010287 0.78 ABL1 (0.53) GABRA1GABRB2PTPN5CSNK2A2CSNK2B
SCHEMBL198461 0.78 CSNK2A2 (0.52) GABRA1GABRB2CSNK2A2CSNK2BCSNK2A1
SCHEMBL11128240 0.78 GABRA1 (0.45) GABRA1GABRB2PTPN5CSNK2A2CSNK2B
SCHEMBL10011887 0.77 HSP90AA1 (0.50) GABRA1GABRB2CSNK2A2CSNK2BCSNK2A1
SCHEMBL11382359 0.76 CSNK2A2 (0.50) GABRA1GABRB2CSNK2A2CSNK2BCSNK2A1

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