SCHEMBL11095349

SCHEMBL11095349

CSc1ccc(Oc2ccc(C(F)(F)F)cc2Cl)cc1O

nearest known ligand 0.67

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
FFAR1 O14842 5/20 0.49
MEN1 O00255 1/20 0.48
TTR P02766 1/20 0.48
PPOX P50336 1/20 0.48
KMT2A Q03164 1/20 0.48
TDP1 Q9NUW8 1/20 0.48
HTR2A P28223 4/20 0.44
SLC6A4 P31645 4/20 0.44
KCNH2 Q12809 4/20 0.44
RAB9A P51151 1/20 0.40
L3MBTL1 Q9Y468 1/20 0.40
ESRRA P11474 1/20 0.39
STK39 Q9UEW8 1/20 0.39
MRGPRX4 Q96LA9 2/20 0.39

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
SCHEMBL10615136 0.84 FFAR1 (0.55) FFAR1MEN1TTRPPOXKMT2A
SCHEMBL32669004 0.84 FFAR1 (0.55) FFAR1MEN1TTRPPOXKMT2A
SCHEMBL11236807 0.83 FFAR1 (0.47) FFAR1MEN1TTRPPOXKMT2A
SCHEMBL10856650 0.83 MEN1 (0.64) FFAR1MEN1TTRPPOXKMT2A
SCHEMBL11056341 0.83 MEN1 (0.55) FFAR1MEN1TTRPPOXKMT2A
SCHEMBL10661112 0.81 TDP1 (0.53) FFAR1MEN1TTRPPOXKMT2A
SCHEMBL8684467 0.81 FFAR1 (0.61) FFAR1MEN1TTRPPOXKMT2A
SCHEMBL11436072 0.80 FFAR1 (0.52) FFAR1MEN1TTRPPOXKMT2A
SCHEMBL11088369 0.80 LMNA (0.50) MEN1TTRPPOXKMT2ATDP1
SCHEMBL11648515 0.80 FFAR1 (0.54) 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
US-4443248-A Phenoxyphenoxypropionic acids and derivatives, and their use as herbicides VELSICOL CHEMICAL CORPORATION (US) 1984-04-17 US disclosed