SCHEMBL1384994

SCHEMBL1384994

COCC1C(=O)N(Cc2ccc3c(N)ncnc3c2)CCN1C(=O)COc1scc(Cl)c1Cl

nearest known ligand 0.41

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
F10 P00742 13/20 0.41
DGAT1 O75907 1/20 0.34
PDPK1 O15530 1/20 0.30
ALDH1A1 P00352 1/20 0.30

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
SCHEMBL1384990 1.00 F10 (0.41) F10DGAT1PDPK1ALDH1A1
SCHEMBL1386556 0.91 F10 (0.41) F10DGAT1
SCHEMBL1386558 0.91 F10 (0.41) F10DGAT1
SCHEMBL1654470 0.89 F10 (0.43) F10DGAT1PDPK1ALDH1A1
SCHEMBL4390321 0.89 F10 (0.43) F10DGAT1PDPK1ALDH1A1
SCHEMBL4385666 0.88 F10 (0.41) F10DGAT1
SCHEMBL1652374 0.88 F10 (0.41) F10DGAT1
SCHEMBL4390330 0.88 F10 (0.43) F10DGAT1PDPK1
SCHEMBL1651777 0.88 F10 (0.43) F10DGAT1PDPK1
SCHEMBL4396331 0.86 F10 (0.41) F10DGAT1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
JP-4829449-B2 2011-12-07 JP claimed
JP-2003508353-A 2003-03-04 JP claimed
EP-1208097-A2 SUBSTITUTED OXOAZAHETEROCYCLYL COMPOUNDS Aventis Pharmaceuticals Inc. (US) 2002-05-29 EP claimed
WO-2001007436-A2 SUBSTITUTED OXOAZAHETEROCYCLYL COMPOUNDS AVENTIS PHARMACEUTICALS INC. (US) 2001-02-01 WO claimed