SCHEMBL2862503

SCHEMBL2862503

CCCc1cc(O)cc(-c2ccccc2)c1O

nearest known ligand 0.50

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
BACE1 P56817 2/20 0.50
PTPN1 P18031 3/20 0.44
PTPN11 Q06124 1/20 0.44
KDM4E B2RXH2 1/20 0.43
MEN1 O00255 1/20 0.43
ALDH1A1 P00352 1/20 0.43
MAPT P10636 1/20 0.43
HPGD P15428 1/20 0.43
MPI P34949 1/20 0.43
KMT2A Q03164 1/20 0.43
ESR2 Q92731 2/20 0.41
ALOX5 P09917 6/20 0.40
ESR1 P03372 1/20 0.38
PTPN2 P17706 1/20 0.38
PTPN6 P29350 1/20 0.38
PDE4B Q07343 1/20 0.38
PTGS2 P35354 3/20 0.37
PELI1 Q96FA3 1/20 0.37

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
SCHEMBL2857390 0.90 BACE1 (0.47) BACE1KDM4EMEN1ALDH1A1MAPT
SCHEMBL2855437 0.89 ALOX5 (0.53) BACE1KDM4EMEN1ALDH1A1MAPT
SCHEMBL2864920 0.87 ALOX5 (0.54) BACE1KDM4EMEN1ALDH1A1MAPT
SCHEMBL28700316 0.84 BACE1 (0.42) BACE1PTPN1ALDH1A1HPGDESR2
SCHEMBL2879316 0.83 PTPN1 (0.40) PTPN1PTPN11ESR2ALOX5ESR1
SCHEMBL23277216 0.81 ESR2 (0.50) BACE1KDM4EMEN1ALDH1A1MAPT
SCHEMBL28600186 0.81 ALOX5 (0.55) BACE1PTPN1PTPN11ESR2ALOX5
SCHEMBL11611357 0.79 PDCD1 (0.50) ALDH1A1HPGDKMT2AALOX5PTGS2
SCHEMBL1022126 0.78 PTPN1 (0.47) BACE1PTPN1HPGDALOX5PTPN2
SCHEMBL22497560 0.78 LTB4R (0.41) BACE1PTPN1KDM4EALDH1A1HPGD

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