SCHEMBL10615136

SCHEMBL10615136

Oc1cc(Oc2ccc(C(F)(F)F)cc2Cl)ccc1Cl

nearest known ligand 0.78

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
FFAR1 O14842 5/20 0.55
MEN1 O00255 1/20 0.54
TTR P02766 1/20 0.54
PPOX P50336 1/20 0.54
KMT2A Q03164 1/20 0.54
TDP1 Q9NUW8 1/20 0.54
HTR2A P28223 4/20 0.50
SLC6A4 P31645 4/20 0.50
KCNH2 Q12809 4/20 0.50
MRGPRX4 Q96LA9 3/20 0.46
STK39 Q9UEW8 1/20 0.43
RAB9A P51151 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
SCHEMBL32669004 0.91 FFAR1 (0.55) FFAR1MEN1TTRPPOXKMT2A
SCHEMBL8684467 0.88 FFAR1 (0.61) FFAR1MEN1TTRPPOXKMT2A
SCHEMBL11436072 0.87 FFAR1 (0.52) FFAR1MEN1TTRPPOXKMT2A
SCHEMBL11095176 0.85 FFAR1 (0.65) FFAR1MEN1TTRPPOXKMT2A
SCHEMBL9711445 0.85 FFAR1 (0.53) FFAR1MEN1TTRPPOXKMT2A
SCHEMBL9572426 0.84 AR (0.53) FFAR1MEN1TTRPPOXKMT2A
SCHEMBL9320189 0.84 POLB (0.53) FFAR1MEN1TTRPPOXKMT2A
SCHEMBL9506722 0.84 MEN1 (0.66) FFAR1MEN1TTRPPOXKMT2A
SCHEMBL11095349 0.84 FFAR1 (0.49) FFAR1MEN1TTRPPOXKMT2A
SCHEMBL11174511 0.84 AR (0.50) HTR2ASLC6A4KCNH2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
JP-56046859-A None JP disclosed
US-4792616-A Diaryl ethers HOFFMANN-LA ROCHE INC. (US) 1988-12-20 US disclosed
US-4629498-A CEREALS AND RICE CROPS CIBA-GEIGY CORPORATION (US) 1986-12-16 US disclosed
EP-0138183-A2 Diarylethers and their use as herbicides F. HOFFMANN-LA ROCHE AG (CH) 1985-04-24 EP disclosed
JP-S5646859-A DIPHENYL ETHER COMPOUND MITSUI TOATSU CHEM INC 1981-04-28 JP disclosed