SCHEMBL6690710

SCHEMBL6690710

NC(=O)CC(NCc1ccc(OCc2ccc(SC(F)(F)F)cc2)cc1)c1ccccc1

nearest known ligand 0.55

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
PTPRZ1 P23471 1/20 0.52
SCN9A Q15858 2/20 0.41
MEN1 O00255 1/20 0.41
POLB P06746 1/20 0.41
MAPK1 P28482 1/20 0.41
KMT2A Q03164 1/20 0.41
NPSR1 Q6W5P4 1/20 0.41
MAOB P27338 2/20 0.41
MAOA P21397 1/20 0.41
SPHK2 Q9NRA0 1/20 0.40
SPHK1 Q9NYA1 1/20 0.40
FFAR1 O14842 1/20 0.40
FFAR4 Q5NUL3 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
SCHEMBL6694094 0.92 PTPRZ1 (0.52) PTPRZ1SCN9AMAOBMAOA
SCHEMBL6691341 0.81 PTPRZ1 (0.53) PTPRZ1SCN9AMAOBMAOA
SCHEMBL6685877 0.79 MAOB (0.61) PTPRZ1SCN9AMAOBMAOA
SCHEMBL6685873 0.79 MAOB (0.61) PTPRZ1SCN9AMAOBMAOA
SCHEMBL6703960 0.78 MAOB (0.54) MAOBFFAR1
SCHEMBL6692779 0.77 BCHE (0.42) MEN1KMT2ANPSR1FFAR4
SCHEMBL6698255 0.76 PTPRZ1 (0.54) PTPRZ1SCN9AMAOBMAOA
SCHEMBL6698258 0.76 PTPRZ1 (0.54) PTPRZ1SCN9AMAOBMAOA
SCHEMBL30745904 0.73 PTPRZ1 (0.72) PTPRZ1MAOB
SCHEMBL30885390 0.72 PTPRZ1 (0.67) PTPRZ1MEN1KMT2AMAOB

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