SCHEMBL2858607

SCHEMBL2858607

CCCc1cccc(Sc2cc(O)ccc2O)c1CCC

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.46
HPGD P15428 3/20 0.46
ALDH1A1 P00352 2/20 0.46
KDM4E B2RXH2 1/20 0.46
G6PD P11413 1/20 0.46
PKM P14618 1/20 0.46
MAPK1 P28482 1/20 0.46
RECQL P46063 1/20 0.46
CCR6 P51684 1/20 0.46
MCL1 Q07820 1/20 0.46
HKDC1 Q2TB90 1/20 0.46
MEN1 O00255 3/20 0.38
ALOX15 P16050 3/20 0.38
KMT2A Q03164 3/20 0.38
TP53 P04637 2/20 0.38
GAA P10253 2/20 0.38
HSD17B10 Q99714 2/20 0.38
LMNA P02545 1/20 0.38
ALOX12 P18054 1/20 0.38
TYR P14679 2/20 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
SCHEMBL2865379 0.89 TYR (0.49) MAPTHPGDALDH1A1KDM4EG6PD
SCHEMBL2859417 0.87 MAPT (0.55) MAPTHPGDALDH1A1KDM4EG6PD
SCHEMBL8371767 0.83 IFNAR1 (0.35) HPGDALDH1A1KDM4EMAPK1GAA
SCHEMBL2866430 0.82 HPGD (0.51) MAPTHPGDALDH1A1KDM4EG6PD
SCHEMBL2865443 0.79 IAPP (0.36) MCL1LTB4RLTB4R2
SCHEMBL2864854 0.78 MAPT (0.53) MAPTHPGDALDH1A1KDM4EG6PD
SCHEMBL2860928 0.77 HPGD (0.61) MAPTHPGDALDH1A1KDM4EG6PD
SCHEMBL2859187 0.77 MAPT (0.53) MAPTHPGDALDH1A1KDM4EG6PD
SCHEMBL2867929 0.76 MAPT (0.55) MAPTHPGDALDH1A1KDM4EG6PD
SCHEMBL2879321 0.75 CNR1 (0.46) MAPTMEN1ALOX15KMT2ATP53

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