SCHEMBL1385334

SCHEMBL1385334

CCCC1C(=O)N(Cc2ccc3c(N)ncnc3c2)CCN1Cc1cc2ccc(Cl)nc2s1

nearest known ligand 0.46

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
F10 P00742 15/20 0.46
DGAT1 O75907 1/20 0.34
HSP90AB1 P08238 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
SCHEMBL1385333 1.00 F10 (0.46) F10DGAT1HSP90AB1
SCHEMBL4391945 0.95 F10 (0.47) F10DGAT1HSP90AB1
SCHEMBL1654420 0.95 F10 (0.47) F10DGAT1HSP90AB1
SCHEMBL4393791 0.90 F10 (0.48) F10DGAT1
SCHEMBL4393796 0.90 F10 (0.48) F10DGAT1
SCHEMBL4388548 0.82 F10 (0.64) F10
SCHEMBL4393358 0.82 F10 (0.59) F10DGAT1
SCHEMBL1651520 0.82 F10 (0.59) F10DGAT1
SCHEMBL27591835 0.82 F10 (0.40) F10
SCHEMBL27579307 0.81 F10 (0.40) F10

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