SCHEMBL365475

SCHEMBL365475

CS(=O)(=O)NC(=O)c1ccc2cc3ccccn3c2c1

nearest known ligand 0.48

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
SCN9A Q15858 18/20 0.48
SCN2B O60939 6/20 0.46
SCN1B Q07699 6/20 0.46
SCN5A Q14524 6/20 0.46
SCN1A P35498 4/20 0.46
PTPN1 P18031 1/20 0.45
MYC P01106 1/20 0.39

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
SCHEMBL366723 0.79 MAPT (0.45)
SCHEMBL365476 0.78 SCN9A (0.46) SCN9ASCN2BSCN1BSCN5ASCN1A
SCHEMBL6851190 0.76 BAZ2B (0.45)
SCHEMBL366783 0.74 SCN9A (0.54) SCN9ASCN2BSCN1BSCN5ASCN1A
SCHEMBL366353 0.72 SCN9A (0.49) SCN9ASCN2BSCN1BSCN5ASCN1A
SCHEMBL6413783 0.70 CHRNA7 (0.39)
SCHEMBL6415487 0.70 CHRNA7 (0.58)
SCHEMBL14195575 0.69 SMN1; SMN2 (0.44) SCN9ASCN2BSCN1BSCN5ASCN1A
SCHEMBL6411859 0.69 F10 (0.39)
SCHEMBL6417462 0.69 KHK (0.37)

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2012007007-A1 INHIBITORS OF HDME EPITHERAPEUTICS APS (DK) 2012-01-19 WO claimed
WO-2012007007-A1 INHIBITORS OF HDME EPITHERAPEUTICS APS (DK) 2012-01-19 WO disclosed