SCHEMBL2855476

SCHEMBL2855476

CCCCc1cc(O)cc(C(=O)c2ccccc2)c1O

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.44
HPGD P15428 2/20 0.44
MAPK1 P28482 2/20 0.44
LMNA P02545 1/20 0.44
CYP1A2 P05177 1/20 0.44
PGR P06401 1/20 0.44
CYP2D6 P10635 1/20 0.44
SLC6A2 P23975 1/20 0.44
PDE4A P27815 1/20 0.44
CYP2C19 P33261 1/20 0.44
HRH1 P35367 1/20 0.44
HTT P42858 1/20 0.44
SLC6A3 Q01959 1/20 0.44
PDE4D Q08499 1/20 0.44
BCL2 P10415 1/20 0.44
MCL1 Q07820 1/20 0.44
MEN1 O00255 1/20 0.43
USP2 O75604 1/20 0.43
GAA P10253 1/20 0.43
KMT2A Q03164 1/20 0.43

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
SCHEMBL2859228 0.91 HPGD (0.47) ALDH1A1HPGDMAPK1LMNACYP1A2
SCHEMBL2868200 0.86 BCL2 (0.54) ALDH1A1HPGDMAPK1LMNACYP1A2
SCHEMBL2855392 0.84 BCL2 (0.43) ALDH1A1HPGDMAPK1BCL2MCL1
SCHEMBL27639750 0.82 HMGB1 (0.46) MAPK1MCL1ALOX5PTGS2CNR2
SCHEMBL29176068 0.82 BCL2 (0.43) ALDH1A1HPGDMAPK1BCL2MCL1
SCHEMBL39883 0.82 GABRP (0.49) ALDH1A1HPGDALOX5PTGS2TYR
SCHEMBL28755013 0.79 KDM4E (0.51) ALDH1A1HPGDMAPK1LMNACYP1A2
SCHEMBL11514944 0.79 MEN1 (0.55) ALDH1A1HPGDMAPK1LMNACYP1A2
SCHEMBL4302289 0.79 MEN1 (0.53) ALDH1A1HPGDMAPK1LMNACYP1A2
SCHEMBL7164776 0.79 AKR1C3 (0.48) ALDH1A1MCL1GAACNR2CES2

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
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
CN-1757130-A Polymer electrolyte material, polymer electrolyte part, film electrode composite element and polymer electrolyte fuel cells TORAY INDUSTRIES (JP) 2006-04-05 CN 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