SCHEMBL6691341

SCHEMBL6691341

NC(=O)C(Cc1ccccc1)NCc1ccc(OCc2ccc(SC(F)(F)F)cc2)cc1

nearest known ligand 0.64

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
PTPRZ1 P23471 1/20 0.53
PPARG P37231 2/20 0.50
MAOB P27338 2/20 0.46
MAOA P21397 1/20 0.46
SCN9A Q15858 1/20 0.46
GPR34 Q9UPC5 1/20 0.46

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
SCHEMBL6698258 0.93 PTPRZ1 (0.54) PTPRZ1PPARGMAOBMAOASCN9A
SCHEMBL6698255 0.93 PTPRZ1 (0.54) PTPRZ1PPARGMAOBMAOASCN9A
SCHEMBL6689649 0.87 MAOB (0.51) PTPRZ1PPARGMAOBMAOAGPR34
SCHEMBL6687209 0.86 MAOB (0.55) PPARGMAOBGPR34
SCHEMBL6687215 0.86 MAOB (0.55) PPARGMAOBGPR34
SCHEMBL6687535 0.86 ITGA4 (0.44) PTPRZ1PPARGMAOBMAOA
SCHEMBL6685530 0.85 FFAR4 (0.48) PPARG
SCHEMBL6685527 0.85 FFAR4 (0.48) PPARG
SCHEMBL6687567 0.85 PPARG (0.42) PTPRZ1PPARG
SCHEMBL6687562 0.85 PPARG (0.42) PTPRZ1PPARG

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
WO-2004087125-A1 AMINO ACID DERIVATIVES AS INHIBITORS OF MAMMALIAN SODIUM CHANNELS IONIX PHARMACEUTICALS LIMITED (GB) 2004-10-14 WO disclosed