SCHEMBL10688351

SCHEMBL10688351

OCc1cccc(Oc2ccc(C(F)(F)F)cc2Cl)c1

nearest known ligand 0.58

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
FFAR1 O14842 3/20 0.54
MRGPRX4 Q96LA9 13/20 0.51
MEN1 O00255 1/20 0.47
TTR P02766 1/20 0.47
PPOX P50336 1/20 0.47
KMT2A Q03164 1/20 0.47
TDP1 Q9NUW8 1/20 0.47
STK39 Q9UEW8 1/20 0.45
MAPT P10636 1/20 0.45
NPSR1 Q6W5P4 1/20 0.45
L3MBTL1 Q9Y468 1/20 0.45

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
SCHEMBL875580 0.89 FFAR1 (0.51) FFAR1TTRSTK39
SCHEMBL10693814 0.88 MRGPRX4 (0.52) FFAR1MRGPRX4MEN1TTRPPOX
SCHEMBL10482190 0.86 MRGPRX4 (0.51) FFAR1MRGPRX4MEN1TTRPPOX
SCHEMBL11260950 0.86 MRGPRX4 (0.51) FFAR1MRGPRX4MEN1TTRPPOX
SCHEMBL10538095 0.85 NPSR1 (0.57) FFAR1MRGPRX4MEN1TTRPPOX
SCHEMBL10508984 0.85 FFAR1 (0.53) FFAR1MRGPRX4MEN1TTRPPOX
SCHEMBL10507700 0.85 FFAR1 (0.62) FFAR1MRGPRX4MEN1TTRPPOX
SCHEMBL10507578 0.85 FFAR1 (0.56) FFAR1MRGPRX4MEN1TTRPPOX
SCHEMBL11205371 0.84 ACP3 (0.59) FFAR1MRGPRX4MEN1TTRPPOX
SCHEMBL3523039 0.83 FFAR1 (0.77) FFAR1MRGPRX4MEN1TTRPPOX

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-4744812-A HALOGENATED DIPHENYL ETHER BASF AKTIENGESELLSCHAFT (DE) 1988-05-17 US disclosed
EP-0056119-A1 Substituted diphenyl ethers, herbicides containing them and their use as herbicides BASF Aktiengesellschaft (DE) 1982-07-21 EP disclosed