SCHEMBL2877480

SCHEMBL2877480

CCCc1ccc(Oc2c(O)ccc(C(=O)c3ccccc3)c2O)cc1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 5/20 0.46
HPGD P15428 4/20 0.46
ALOX15 P16050 4/20 0.46
HSD17B10 Q99714 4/20 0.46
ALDH1A1 P00352 3/20 0.46
KDM4E B2RXH2 3/20 0.46
RECQL P46063 2/20 0.46
MAPK1 P28482 3/20 0.45
LMNA P02545 3/20 0.45
HTT P42858 3/20 0.45
CYP1A2 P05177 1/20 0.45
PGR P06401 1/20 0.45
CYP2D6 P10635 1/20 0.45
SLC6A2 P23975 1/20 0.45
PDE4A P27815 1/20 0.45
CYP2C19 P33261 1/20 0.45
HRH1 P35367 1/20 0.45
SLC6A3 Q01959 1/20 0.45
PDE4D Q08499 1/20 0.45
SRD5A2 P31213 4/20 0.44

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
SCHEMBL27677099 0.93 STAT3 (0.45) MAPTHPGDALOX15HSD17B10ALDH1A1
SCHEMBL2872542 0.90 HPGD (0.48) MAPTHPGDALOX15HSD17B10ALDH1A1
SCHEMBL28496809 0.84 MAPT (0.50) MAPTHPGDALOX15HSD17B10ALDH1A1
SCHEMBL2879413 0.83 HPGD (0.50) MAPTHPGDALOX15HSD17B10ALDH1A1
SCHEMBL21275711 0.78 HPGD (0.52) MAPTHPGDALOX15HSD17B10ALDH1A1
SCHEMBL28328950 0.77 KMT2A (0.58) MAPTHPGDHSD17B10ALDH1A1KDM4E
SCHEMBL2878591 0.77 HPGD (0.47) MAPTHPGDALDH1A1MAPK1LMNA
SCHEMBL28495783 0.77 CCNB2 (0.51) MAPTHPGDALOX15HSD17B10ALDH1A1
SCHEMBL30024179 0.76 KDM4E (0.61) MAPTHPGDALOX15HSD17B10ALDH1A1
SCHEMBL2862125 0.74 MAPT (0.49) MAPTHPGDALOX15HSD17B10ALDH1A1

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