SCHEMBL7496147

SCHEMBL7496147

CC(C)C(N)[C@@H]1CN(S(=O)(=O)c2cc3cc(Cl)ccc3[nH]2)CC(=O)N1Cc1ccc2c(N)ncnc2c1

nearest known ligand 0.54

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
F10 P00742 19/20 0.54
KCNH2 Q12809 1/20 0.47

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
SCHEMBL4392344 0.94 F10 (0.55) F10KCNH2
SCHEMBL1385526 0.94 F10 (0.55) F10KCNH2
SCHEMBL4392340 0.94 F10 (0.55) F10KCNH2
SCHEMBL1386379 0.90 F10 (0.55) F10KCNH2
SCHEMBL1384632 0.90 F10 (0.55) F10KCNH2
SCHEMBL1386852 0.90 F10 (0.55) F10KCNH2
SCHEMBL4390160 0.89 F10 (0.56) F10KCNH2
SCHEMBL1384222 0.89 F10 (0.56) F10KCNH2
SCHEMBL4390971 0.89 F10 (0.56) F10KCNH2
SCHEMBL4394673 0.89 F10 (0.56) F10KCNH2

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
EP-1208097-A2 SUBSTITUTED OXOAZAHETEROCYCLYL COMPOUNDS Aventis Pharmaceuticals Inc. (US) 2002-05-29 EP disclosed
WO-2001007436-A2 SUBSTITUTED OXOAZAHETEROCYCLYL COMPOUNDS AVENTIS PHARMACEUTICALS INC. (US) 2001-02-01 WO disclosed