SCHEMBL10073799

SCHEMBL10073799

COc1ccc(C(c2ccc(CO)cc2)c2ccc(CO)cc2)cc1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SLC2A1 P11166 1/20 0.53
CYP1A2 P05177 1/20 0.52
CYP2D6 P10635 1/20 0.52
CYP2C19 P33261 1/20 0.52
LDHA P00338 1/20 0.47
IDO1 P14902 2/20 0.47
KDM4E B2RXH2 1/20 0.47
GAA P10253 1/20 0.47
SLC6A4 P31645 1/20 0.46
AOC3 Q16853 2/20 0.44
CALM1 P0DP23 1/20 0.44
CA12 O43570 1/20 0.44
CA1 P00915 1/20 0.44
CA2 P00918 1/20 0.44
CA7 P43166 1/20 0.44
CA9 Q16790 1/20 0.44
CA14 Q9ULX7 1/20 0.44
LTA4H P09960 2/20 0.44
AGXT P21549 1/20 0.44
TAAR1 Q96RJ0 1/20 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
SCHEMBL17356548 1.00 SLC2A1 (0.53) SLC2A1CYP1A2CYP2D6CYP2C19LDHA
SCHEMBL2620571 1.00 SLC2A1 (0.53) SLC2A1CYP1A2CYP2D6CYP2C19LDHA
SCHEMBL12391392 0.93 LTA4H (0.52) SLC2A1CYP1A2CYP2D6CYP2C19LDHA
SCHEMBL27329 0.87 IDO1 (0.58) LDHAIDO1SLC6A4CALM1CA12
SCHEMBL4181089 0.87 IDO1 (0.58) LDHAIDO1SLC6A4CALM1CA12
SCHEMBL13539012 0.86 CYP1A2 (0.50) CYP1A2CYP2D6CYP2C19LDHAIDO1
SCHEMBL1475480 0.85 IDO1 (0.56) LDHAIDO1SLC6A4CALM1CA12
SCHEMBL1477048 0.85 IDO1 (0.56) LDHAIDO1SLC6A4CALM1CA12
Methyl Alcohol SCHEMBL28311094 0.85 IDO1 (0.56) LDHAIDO1SLC6A4CALM1CA12
Methoxymethane SCHEMBL28284584 0.85 IDO1 (0.56) LDHAIDO1SLC6A4CALM1CA12

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20120027463-A1 IMAGE FORMING APPARATUS RICOH COMPANY, LTD. (JP) 2012-02-02 US disclosed