SCHEMBL20795337

SCHEMBL20795337

COCc1cccc(Oc2cccc(COC)c2)c1

nearest known ligand 0.55

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
IDO1 P14902 2/20 0.55
AGXT P21549 2/20 0.55
KDM4E B2RXH2 3/20 0.47
ALDH1A1 P00352 3/20 0.47
HTT P42858 1/20 0.47
SMN1; SMN2 Q16637 1/20 0.47
MAOB P27338 6/20 0.47
TAAR1 Q96RJ0 3/20 0.46
MEN1 O00255 1/20 0.44
KMT2A Q03164 1/20 0.44
TDP1 Q9NUW8 1/20 0.44
CETP P11597 1/20 0.43

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
SCHEMBL2093737 0.94 KDM4E (0.55) IDO1AGXTKDM4EALDH1A1HTT
SCHEMBL31264 0.87 IDO1 (0.71) IDO1AGXTMAOBTAAR1
SCHEMBL4911820 0.85 IDO1 (0.42) IDO1AGXTKDM4EALDH1A1HTT
SCHEMBL13970685 0.85 IDO1 (0.53) IDO1HTTMAOB
SCHEMBL15160177 0.85 AR (0.43) IDO1AGXTMAOB
SCHEMBL487468 0.84 IDO1 (0.48) IDO1AGXTMAOB
SCHEMBL18956965 0.83 IDO1 (0.45) IDO1AGXTKDM4EALDH1A1HTT
SCHEMBL10603118 0.83 SMN1; SMN2 (0.52) KDM4EALDH1A1HTTSMN1; SMN2MAOB
SCHEMBL15160167 0.82 PPARG (0.43) IDO1AGXTKDM4EALDH1A1HTT
SCHEMBL15160188 0.82 IDO1 (0.44) IDO1AGXTKDM4EALDH1A1HTT

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20190148756-A1 METHOD FOR PRODUCING POLYMER ELECTROLYTE MOLDED ARTICLE, POLYMER ELECTROLYTE MATERIAL, POLYMER ELECTROLYTE MEMBRANE, AND POLYMER ELECTROLYTE FUEL CELL TORAY INDUSTRIES, INC. (JP) 2019-05-16 US disclosed
US-10224562-B2 Method for producing polymer electrolyte molded article, polymer electrolyte material, polymer electrolyte membrane, and polymer electrolyte fuel cell TORAY INDUSTRIES, INC. (JP) 2019-03-05 US disclosed