SCHEMBL7501370

SCHEMBL7501370

CC(C)NC[C@H]1CN(S(=O)(=O)c2nc3ccc(Cl)cc3[nH]2)CC(=O)N1Cc1ccc2c(N)ncnc2c1

nearest known ligand 0.68

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
F10 P00742 17/20 0.68
KCNH2 Q12809 1/20 0.35
PKM P14618 1/20 0.32
HRH4 Q9H3N8 1/20 0.32

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
SCHEMBL1386956 0.92 F10 (0.71) F10KCNH2PKMHRH4
SCHEMBL1386023 0.92 F10 (0.71) F10KCNH2PKMHRH4
SCHEMBL1386396 0.92 F10 (0.71) F10KCNH2PKMHRH4
SCHEMBL1386667 0.90 F10 (0.53) F10KCNH2
SCHEMBL1385404 0.89 F10 (0.52) F10KCNH2
SCHEMBL1386474 0.89 F10 (0.69) F10KCNH2
SCHEMBL1385076 0.89 F10 (0.69) F10KCNH2
SCHEMBL1385075 0.89 F10 (0.69) F10KCNH2
SCHEMBL1385897 0.89 F10 (0.71) F10KCNH2HRH4
SCHEMBL4391111 0.89 F10 (0.71) F10KCNH2HRH4

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