SCHEMBL2867929

SCHEMBL2867929

CCCCCCc1ccccc1Sc1cc(O)ccc1O

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.55
TYR P14679 3/20 0.55
CYP3A4 P08684 3/20 0.55
TP53 P04637 2/20 0.55
MEN1 O00255 1/20 0.55
ALOX5 P09917 1/20 0.55
ALOX15 P16050 1/20 0.55
TSHR P16473 1/20 0.55
HTT P42858 1/20 0.55
KMT2A Q03164 1/20 0.55
TDP1 Q9NUW8 1/20 0.55
MCL1 Q07820 4/20 0.51
KDM4E B2RXH2 3/20 0.51
ALDH1A1 P00352 3/20 0.51
HPGD P15428 2/20 0.51
G6PD P11413 1/20 0.51
PKM P14618 1/20 0.51
MAPK1 P28482 1/20 0.51
RECQL P46063 1/20 0.51
CCR6 P51684 1/20 0.51

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
SCHEMBL2859187 0.99 MAPT (0.53) MAPTTYRCYP3A4TP53MEN1
SCHEMBL2864854 0.94 MAPT (0.53) MAPTTYRCYP3A4TP53MEN1
SCHEMBL2859417 0.88 MAPT (0.55) MAPTTYRCYP3A4TP53MEN1
SCHEMBL1800362 0.83 LIPG (0.56) ALOX5MCL1LIPGBIDBCL2L1
SCHEMBL10698150 0.83 LIPG (0.56) ALOX5MCL1LIPGBIDBCL2L1
SCHEMBL5443171 0.83 LIPG (0.56) ALOX5MCL1LIPGBIDBCL2L1
SCHEMBL786161 0.83 LIPG (0.56) ALOX5MCL1LIPGBIDBCL2L1
SCHEMBL2865379 0.82 TYR (0.49) MAPTTYRCYP3A4TP53MEN1
SCHEMBL2860928 0.82 HPGD (0.61) MAPTCYP3A4TP53MEN1ALOX15
SCHEMBL6404803 0.82 LIPG (0.55) ALOX5MCL1LIPGBIDBCL2L1

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