SCHEMBL6164026

SCHEMBL6164026

NC(=O)NN=Cc1ccc(Oc2ccc(Cl)cc2F)cc1

nearest known ligand 0.63

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
SCN9A Q15858 9/20 0.63
SCN4A P35499 1/20 0.63
KMT2A Q03164 2/20 0.50
MEN1 O00255 1/20 0.50
FPR2 P25090 3/20 0.48
MAPT P10636 2/20 0.45
MAPK1 P28482 2/20 0.45
ALDH1A1 P00352 1/20 0.45
GAA P10253 1/20 0.45

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
SCHEMBL6163664 0.85 SCN4A (0.74) SCN9ASCN4AKMT2AMEN1MAPT
SCHEMBL6166125 0.83 SCN4A (0.74) SCN9ASCN4AKMT2AMEN1MAPT
SCHEMBL6165867 0.81 SCN4A (0.75) SCN9ASCN4AKMT2AMEN1MAPT
SCHEMBL7921348 0.80 SCN9A (0.65) SCN9ASCN4AKMT2AMEN1MAPT
SCHEMBL6142718 0.79 SCN9A (0.47) SCN9ASCN4AFPR2
SCHEMBL29405312 0.78 SCN4A (1.00) SCN9ASCN4AKMT2AMEN1MAPT
SCHEMBL30320026 0.78 SCN4A (1.00) SCN9ASCN4AKMT2AMEN1MAPT
SCHEMBL6164077 0.78 SCN4A (1.00) SCN9ASCN4AKMT2AMEN1MAPT
SCHEMBL17560884 0.77 PRMT5 (0.61) SCN9ASCN4AKMT2AMEN1MAPT
SCHEMBL17560882 0.77 PRMT5 (0.61) SCN9ASCN4AKMT2AMEN1MAPT

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-0986540-B1 THE USE OF CARBOCYCLIC AND HETEROCYCLIC SUBSTITUTED SEMICARBAZONES AND THIOSEMICARBAZONES AS SODIUM CHANNEL BLOCKERS EURO CELTIQUE SA (LU) 2005-02-16 EP claimed