SCHEMBL23048342

SCHEMBL23048342

CNc1cccc(C(=O)Nc2c(Br)cc(C(F)(C(F)(F)F)C(F)(F)F)cc2C(F)(F)C(F)(F)F)c1F

nearest known ligand 0.37

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 2/20 0.37
RXFP1 Q9HBX9 9/20 0.37
PTGES O14684 2/20 0.33
BRAF P15056 1/20 0.33
TAS2R14 Q9NYV8 2/20 0.33
PPARG P37231 2/20 0.32
NR1H4 Q96RI1 2/20 0.32
PPARA Q07869 1/20 0.32

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
SCHEMBL29634361 0.93 SMN1; SMN2 (0.43) SMN1; SMN2RXFP1PTGESBRAFTAS2R14
SCHEMBL1766396 0.93 SMN1; SMN2 (0.43) SMN1; SMN2RXFP1PTGESBRAFTAS2R14
SCHEMBL2240566 0.92 RXFP1 (0.41) SMN1; SMN2RXFP1
SCHEMBL23048324 0.89 NR1H4 (0.42) RXFP1BRAFPPARGNR1H4PPARA
SCHEMBL21727444 0.89 PDK1 (0.39) SMN1; SMN2RXFP1PTGES
SCHEMBL1766943 0.87 RXFP1 (0.44) SMN1; SMN2RXFP1PPARGNR1H4PPARA
SCHEMBL1767106 0.86 RXFP1 (0.39) SMN1; SMN2RXFP1BRAF
SCHEMBL1766826 0.85 PTGS1 (0.39) SMN1; SMN2RXFP1
SCHEMBL12356415 0.85 RXFP1 (0.40) SMN1; SMN2RXFP1PPARGNR1H4PPARA
SCHEMBL23070825 0.84 RXFP1 (0.40) SMN1; SMN2RXFP1BRAF

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-3081552-B1 PEST CONTROL AGENT CONTAINING AN AMIDE DERIVATIVE AND USE OF THE PEST CONTROL AGENT MITSUI CHEMICALS AGRO INC (JP) 2021-03-03 EP disclosed