SCHEMBL20115715

SCHEMBL20115715

NC1CCC(CCNc2cc(F)c(SNc3nccs3)cc2Cl)CC1

nearest known ligand 0.66

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
SCN5A Q14524 12/20 0.66
CYP3A4 P08684 10/20 0.66
SCN9A Q15858 10/20 0.66

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
SCHEMBL23913155 0.90 SCN5A (0.54) SCN5ACYP3A4SCN9A
SCHEMBL20115622 0.90 SCN5A (0.65) SCN5ACYP3A4SCN9A
SCHEMBL20115586 0.87 SCN9A (0.67) SCN5ACYP3A4SCN9A
SCHEMBL23913156 0.85 SCN9A (0.67) SCN5ACYP3A4SCN9A
SCHEMBL20115767 0.84 SCN9A (0.68) SCN5ACYP3A4SCN9A
SCHEMBL20182507 0.83 SCN9A (0.47) SCN5ACYP3A4SCN9A
SCHEMBL20115783 0.81 SCN5A (0.64) SCN5ACYP3A4SCN9A
SCHEMBL19000751 0.81 SCN5A (0.42) SCN5ACYP3A4SCN9A
SCHEMBL20115636 0.81 SCN5A (0.65) SCN5ACYP3A4SCN9A
SCHEMBL20115642 0.81 SCN9A (0.68) SCN5ACYP3A4SCN9A

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-2018081384-A1 ACYL SULFONAMIDE NAV1.7 INHIBITORS BRISTOL-MYERS SQUIBB COMPANY (US) 2018-05-03 WO disclosed