SCHEMBL10379940

SCHEMBL10379940

Cc1nn(-c2cnc(C3CC3)c(Cl)c2)c2ccc(C(=O)NS(C)(=O)=O)cc12

nearest known ligand 0.67

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
SCN9A Q15858 19/20 0.67
SCN2B O60939 10/20 0.46
SCN1B Q07699 10/20 0.46
SCN5A Q14524 10/20 0.46
SCN1A P35498 8/20 0.46
CHRM4 P08173 1/20 0.41

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
SCHEMBL10380538 0.88 SCN9A (0.73) SCN9ASCN2BSCN1BSCN5ASCN1A
SCHEMBL10324443 0.86 SCN9A (0.70) SCN9ASCN2BSCN1BSCN5ASCN1A
SCHEMBL10379911 0.84 SCN9A (0.58) SCN9ASCN2BSCN1BSCN5ASCN1A
SCHEMBL10379494 0.84 SCN9A (0.79) SCN9ASCN2BSCN1BSCN5ASCN1A
SCHEMBL10324725 0.83 SCN9A (0.67) SCN9ASCN2BSCN1BSCN5ASCN1A
SCHEMBL10380143 0.82 SCN9A (0.51) SCN9ASCN2BSCN1BSCN5ASCN1A
SCHEMBL10379112 0.81 SCN9A (0.73) SCN9ASCN5A
Pf-05241328 SCHEMBL10324699 0.80 SCN9A (1.00) SCN9ASCN5A
SCHEMBL10379433 0.80 SCN9A (0.73) SCN9ASCN2BSCN1BSCN5ASCN1A
Pf-05241328 SCHEMBL30275387 0.80 SCN9A (1.00) SCN9ASCN5A

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-2012095781-A1 INDAZOLE DERIVATIVES AS SODIUM CHANNEL INHIBITORS PFIZER LIMITED (GB) 2012-07-19 WO disclosed