SCHEMBL2864098

SCHEMBL2864098

Cc1c(O)cc(-c2ccccc2)c(O)c1C

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
BACE1 P56817 2/20 0.60
PDE4B Q07343 3/20 0.51
PDE4A P27815 2/20 0.47
PDE4C Q08493 2/20 0.47
PDE4D Q08499 2/20 0.47
ESR2 Q92731 1/20 0.47
ALOX5 P09917 2/20 0.47
ALDH1A1 P00352 3/20 0.46
HPGD P15428 2/20 0.46
HSD17B10 Q99714 2/20 0.46
BCL2L1 Q07817 1/20 0.46
PTPN1 P18031 2/20 0.43
CA12 O43570 1/20 0.41
TNF P01375 1/20 0.41
CA9 Q16790 1/20 0.41
NOD2 Q9HC29 1/20 0.41
NOD1 Q9Y239 1/20 0.41
PDCD1 Q15116 1/20 0.41
CD274 Q9NZQ7 1/20 0.41
HDAC4 P56524 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
SCHEMBL5835181 0.83 ESR2 (0.52) BACE1PDE4BPDE4APDE4CPDE4D
SCHEMBL28602556 0.83 BACE1 (0.60) BACE1PDE4BPDE4APDE4CPDE4D
SCHEMBL22713817 0.82 BACE1 (0.58) BACE1PDE4BPDE4APDE4CPDE4D
SCHEMBL7649543 0.82 BACE1 (0.58) BACE1PDE4BPDE4APDE4CPDE4D
SCHEMBL29289442 0.80 PDE4B (0.46) BACE1PDE4BPDE4APDE4CPDE4D
SCHEMBL2860153 0.79 ESR2 (0.52) BACE1PDE4BPDE4APDE4CPDE4D
SCHEMBL5531059 0.79 BACE1 (0.60) BACE1PDE4BPDE4APDE4CPDE4D
SCHEMBL28972367 0.79 BACE1 (0.54) BACE1PDE4BPDE4APDE4CPDE4D
SCHEMBL2865463 0.77 BACE1 (0.50) BACE1PDE4BPDE4APDE4CPDE4D
SCHEMBL1754202 0.77 BACE1 (1.00) BACE1PDE4BPDE4APDE4CPDE4D

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