SCHEMBL14237682

SCHEMBL14237682

COc1cc(Cl)cc(-c2ccc(NC(=O)c3cnnn3C)nc2N)c1Cl

nearest known ligand 0.61

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
SCN10A Q9Y5Y9 13/20 0.61
SCN9A Q15858 3/20 0.52
SCN1A P35498 2/20 0.52
SCN5A Q14524 2/20 0.52
SCN2A Q99250 2/20 0.50
SCN3A Q9NY46 2/20 0.50
KCNH2 Q12809 1/20 0.41
NPC1 O15118 2/20 0.38
FGFR3 P22607 2/20 0.38
MAPT P10636 1/20 0.38
MEN1 O00255 1/20 0.37
RAB9A P51151 1/20 0.37
KMT2A Q03164 1/20 0.37
RXFP1 Q9HBX9 1/20 0.37
F10 P00742 2/20 0.37
HTR2A P28223 1/20 0.37
HTR2C P28335 1/20 0.37

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
SCHEMBL14237413 0.88 SCN10A (0.74) SCN10ASCN9ASCN1ASCN5ASCN2A
SCHEMBL263363 0.86 SCN10A (0.81) SCN10ASCN9ASCN1ASCN5ASCN2A
SCHEMBL14237556 0.85 SCN10A (0.61) SCN10ASCN9ASCN1ASCN5ASCN2A
SCHEMBL14237636 0.82 SCN10A (0.63) SCN10ASCN9ASCN1ASCN5ASCN2A
SCHEMBL14237524 0.82 SCN10A (0.76) SCN10ASCN9ASCN1ASCN5ASCN2A
SCHEMBL14237427 0.80 SCN10A (0.64) SCN10ASCN9ASCN1ASCN5ASCN2A
SCHEMBL14237701 0.80 SCN10A (0.72) SCN10ASCN9ASCN1ASCN5ASCN2A
SCHEMBL262885 0.78 SCN10A (0.79) SCN10ASCN9ASCN1ASCN5ASCN2A
SCHEMBL14237513 0.77 SCN10A (0.64) SCN10ASCN9ASCN1ASCN5ASCN2A
SCHEMBL263242 0.77 SCN10A (0.55) SCN10ASCN9ASCN1ASCN5ASCN2A

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-2183241-B1 2-PYRIDINE CARBOXAMIDE DERIVATIVES AS SODIUM CHANNEL MODULATORS PFIZER LTD (GB) 2012-12-19 EP disclosed