SCHEMBL3122299

SCHEMBL3122299

O=C(NCc1ccc(C(F)(F)F)c(Cl)c1)c1ccc(S(=O)(=O)NC2=NC(O)C(F)S2)cc1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SCN3A Q9NY46 9/20 0.55
MAPT P10636 5/20 0.46
MEN1 O00255 2/20 0.46
KMT2A Q03164 2/20 0.46
HTT P42858 1/20 0.46
NPSR1 Q6W5P4 1/20 0.46
CA1 P00915 1/20 0.43
CA2 P00918 1/20 0.43
CA7 P43166 1/20 0.43
CA9 Q16790 1/20 0.43
LMNA P02545 2/20 0.43
ROCK2 O75116 2/20 0.39
SCN1A P35498 2/20 0.38
SCN5A Q14524 2/20 0.38
SCN9A Q15858 2/20 0.38
SCN2A Q99250 2/20 0.38
SCN8A Q9UQD0 2/20 0.38
SCN10A Q9Y5Y9 2/20 0.38
KCNH2 Q12809 1/20 0.38
USP2 O75604 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
SCHEMBL3122303 1.00 SCN3A (0.55) SCN3AMAPTMEN1KMT2AHTT
SCHEMBL13392070 0.87 SCN3A (0.65) SCN3AMAPTMEN1KMT2AHTT
SCHEMBL3154391 0.79 SCN3A (0.56) SCN3AMAPTMEN1KMT2AHTT
SCHEMBL3129685 0.78 SCN3A (0.77) SCN3AMAPTMEN1KMT2AHTT
SCHEMBL3161091 0.78 SCN3A (0.64) SCN3AMAPTMEN1KMT2AHTT
SCHEMBL3154263 0.78 SCN3A (0.86) SCN3AMAPTMEN1KMT2AHTT
SCHEMBL3127375 0.77 SCN3A (0.73) SCN3AMAPTMEN1KMT2AHTT
SCHEMBL3127402 0.77 SCN3A (0.52) SCN3AROCK2SCN1ASCN5ASCN9A
SCHEMBL3127419 0.77 SCN3A (0.69) SCN3ALMNAROCK2SCN1ASCN5A
SCHEMBL3127424 0.77 SCN3A (0.69) SCN3ALMNAROCK2SCN1ASCN5A

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-2010035166-A1 BENZAMIDE DERIVATIVES PFIZER LIMITED (GB) 2010-04-01 WO disclosed