SCHEMBL20095939

SCHEMBL20095939

Cc1nc(NS(=O)(=O)c2cc(Cl)c(N)cc2F)sc1Cl

nearest known ligand 0.56

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
SCN9A Q15858 9/20 0.56
HSD11B1 P28845 2/20 0.42
SCN5A Q14524 8/20 0.39
SCN8A Q9UQD0 8/20 0.39
SCN1A P35498 6/20 0.39
HTT P42858 1/20 0.39
FSCN1 Q16658 1/20 0.38
NR1I2 O75469 1/20 0.38
CYP2D6 P10635 1/20 0.38
CYP2C9 P11712 1/20 0.38

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
SCHEMBL20096114 0.90 SCN9A (0.56) SCN9AHSD11B1SCN5ASCN8ASCN1A
SCHEMBL20063809 0.89 SCN9A (0.59) SCN9AHSD11B1SCN5ASCN8ASCN1A
SCHEMBL20096207 0.78 SCN9A (0.54) SCN9AHSD11B1SCN5ASCN8ASCN1A
SCHEMBL19000649 0.78 SCN8A (0.57) SCN9ASCN5ASCN8ASCN1ANR1I2
SCHEMBL20095581 0.75 SCN5A (0.59) SCN9ASCN5ASCN8ASCN1A
SCHEMBL20063614 0.73 SCN9A (1.00) SCN9A
SCHEMBL20095908 0.70 SCN1A (0.59) SCN9ASCN5ASCN8ASCN1A
SCHEMBL29668928 0.70 SCN1A (0.59) SCN9ASCN5ASCN8ASCN1ANR1I2
SCHEMBL20238319 0.70 SCN1A (0.59) SCN9ASCN5ASCN8ASCN1ANR1I2
SCHEMBL20096061 0.69 SCN9A (0.33) SCN9A

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-2018072602-A1 THERAPEUTIC COMPOUNDS AND METHODS OF USE THEREOF GENENTECH, INC. (US) 2018-04-26 WO disclosed