SCHEMBL2860947

SCHEMBL2860947

CCCc1cc(O)c(Oc2ccccc2)c(CCC)c1O

nearest known ligand 0.43

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
PPARG P37231 3/20 0.41
PPARA Q07869 3/20 0.41
KDM4E B2RXH2 1/20 0.39
ALDH1A1 P00352 1/20 0.39
GLA P06280 1/20 0.39
GAA P10253 1/20 0.39
HPGD P15428 1/20 0.39
MAPK1 P28482 1/20 0.39
CASP1 P29466 1/20 0.39
CASP7 P55210 1/20 0.39
NPSR1 Q6W5P4 1/20 0.39
HSD17B10 Q99714 1/20 0.39
LTA4H P09960 1/20 0.36
TTR P02766 1/20 0.36
HMGCR P04035 1/20 0.35
ALOX5 P09917 1/20 0.35
ALOX15 P16050 1/20 0.34
ALOX12 P18054 1/20 0.34

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
SCHEMBL2853752 0.89 ALOX5 (0.42) KDM4EALDH1A1GLAGAAHPGD
SCHEMBL2862518 0.88 KDM4E (0.39) PPARGPPARAKDM4EALDH1A1GLA
SCHEMBL982658 0.82 KDM4E (0.38) PPARGPPARAKDM4EALDH1A1GLA
SCHEMBL2865307 0.82 KDM4E (0.46) KDM4EALDH1A1GLAGAAHPGD
SCHEMBL2860923 0.80 LTA4H (0.41) KDM4EALDH1A1GLAGAAHPGD
SCHEMBL5204628 0.78 LTA4H (0.46) PPARGHSD17B10LTA4H
SCHEMBL982178 0.78 KDM4E (0.42) PPARGPPARAKDM4EALDH1A1GLA
SCHEMBL2867962 0.77 HPGD (0.41) KDM4EALDH1A1GLAGAAHPGD
SCHEMBL2867827 0.77 PRKCI (0.45) KDM4EALDH1A1GLAGAAHPGD
SCHEMBL984039 0.76 MEN1 (0.40) KDM4EALDH1A1GLAGAAHPGD

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 3 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
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