SCHEMBL2863680

SCHEMBL2863680

CCCCc1ccccc1Oc1cc(O)ccc1O

nearest known ligand 0.53

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
TYR P14679 2/20 0.53
ALOX5 P09917 4/20 0.46
KMT2A Q03164 2/20 0.46
MEN1 O00255 1/20 0.46
TP53 P04637 1/20 0.46
CYP3A4 P08684 1/20 0.46
MAPT P10636 1/20 0.46
ALOX15 P16050 1/20 0.46
TSHR P16473 1/20 0.46
HTT P42858 1/20 0.46
TDP1 Q9NUW8 1/20 0.46
PTGS2 P35354 2/20 0.43
MAOB P27338 1/20 0.42
THRA P10827 1/20 0.41
THRB P10828 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
SCHEMBL2862332 0.96 ALOX5 (0.53) TYRALOX5KMT2AMEN1TP53
SCHEMBL2865300 0.94 ALOX5 (0.55) TYRALOX5KMT2AMEN1TP53
SCHEMBL2860919 0.91 SLC6A2 (0.45) TYRKMT2AMAOB
SCHEMBL2853750 0.89 TYR (0.50) TYRALOX5KMT2AMEN1TP53
SCHEMBL982212 0.86 ALOX5 (0.49) TYRALOX5PTGS2THRATHRB
SCHEMBL2863925 0.84 KMT2A (0.56) KMT2AMAPTMAOB
SCHEMBL36193 0.82 THRA (0.49) ALOX5CYP3A4PTGS2THRATHRB
SCHEMBL983622 0.81 ALOX5 (0.55) ALOX5PTGS2THRATHRB
SCHEMBL1840588 0.80 ALOX5 (0.54) ALOX5PTGS2THRATHRB
SCHEMBL984478 0.80 ALOX5 (0.54) ALOX5PTGS2THRATHRB

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 5 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
EP-0323126-A2 Liquid-crystalline, thermotropic aromatic polyesters Montedison S.p.A. (IT) 1989-07-05 EP disclosed