SCHEMBL11095342

SCHEMBL11095342

[O]c1cc(Oc2ccc(C(F)(F)F)cc2Cl)ccc1Cl

nearest known ligand 0.64

Predicted protein targets (top 14)

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 5/20 0.50
SLC6A4 P31645 5/20 0.50
KCNH2 Q12809 5/20 0.50
MRGPRX4 Q96LA9 4/20 0.43
RAB9A P51151 1/20 0.42
L3MBTL1 Q9Y468 1/20 0.42
STK39 Q9UEW8 1/20 0.41
EPAS1 Q99814 1/20 0.40

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
SCHEMBL11095176 0.85 FFAR1 (0.65) FFAR1MEN1TTRPPOXKMT2A
SCHEMBL10482181 0.85 HTR2A (0.53) FFAR1MEN1TTRPPOXKMT2A
SCHEMBL8684464 0.84 FFAR1 (0.61) FFAR1MEN1TTRPPOXKMT2A
SCHEMBL10931184 0.83 TDP1 (0.71) FFAR1MEN1TTRPPOXKMT2A
SCHEMBL10615136 0.82 FFAR1 (0.55) FFAR1MEN1TTRPPOXKMT2A
SCHEMBL8812673 0.82 L3MBTL1 (0.52) FFAR1MEN1TTRPPOXKMT2A
SCHEMBL10482242 0.82 FFAR1 (0.52) FFAR1MEN1TTRPPOXKMT2A
SCHEMBL11124773 0.81 MEN1 (0.54) FFAR1MEN1TTRPPOXKMT2A
SCHEMBL10538095 0.81 NPSR1 (0.57) FFAR1MEN1TTRPPOXKMT2A
SCHEMBL10969104 0.81 FFAR1 (0.60) FFAR1MEN1TTRPPOXKMT2A

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
EP-0025773-B1 ALKYLCARBOXYLIC ACID DERIVATIVES THAT CONTAIN SULPHUR AND THAT SHOW A HERBICIDAL AND PLANT GROWTH CONTROLLING ACTIVITY, THEIR PREPARATION AND USE CIBA-GEIGY AG (CH) 1984-08-01 EP disclosed