SCHEMBL23770778

SCHEMBL23770778

CCc1ccccc1-c1nc(NS(=O)(=O)c2cccc(N3CCCCC3)n2)ccc1C(F)(F)F

nearest known ligand 0.37

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
SCN9A Q15858 1/20 0.37
SCN1A P35498 5/20 0.36
SCN8A Q9UQD0 5/20 0.36
TP53 P04637 1/20 0.35
KMO O15229 5/20 0.35
CNR2 P34972 1/20 0.35
SCN5A Q14524 3/20 0.34
CACNA1C Q13936 1/20 0.34
PDE10A Q9Y233 1/20 0.34
S1PR1 P21453 1/20 0.34
SCN10A Q9Y5Y9 1/20 0.33
CHRM4 P08173 1/20 0.33

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
SCHEMBL19970123 0.88 SCN9A (0.39) SCN9ASCN1ASCN8ATP53KMO
SCHEMBL19968866 0.87 SCN9A (0.39) SCN9ASCN1ASCN8ATP53KMO
SCHEMBL19925424 0.86 ITGB2 (0.38) SCN1ASCN8A
SCHEMBL29464387 0.86 ITGB2 (0.38) SCN1ASCN8A
SCHEMBL19925422 0.86 ITGB2 (0.38) SCN1ASCN8A
SCHEMBL19925788 0.86 ITGB2 (0.38) SCN1ASCN8A
SCHEMBL29464328 0.86 ITGB2 (0.38) SCN1ASCN8A
SCHEMBL22323499 0.86 S1PR1 (0.38) SCN1ASCN8AS1PR1
SCHEMBL19951401 0.86 SCN9A (0.33) SCN9ASCN1ASCN8AS1PR1
SCHEMBL19925421 0.86 SCN9A (0.33) SCN9ASCN1ASCN8AS1PR1

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-3504194-B1 N-(PYRIDIN-2-YL)PYRIDINE-SULFONAMIDE DERIVATIVES AND THEIR USE IN THE TREATMENT OF DISEASE NOVARTIS AG (CH) 2021-08-18 EP disclosed