SCHEMBL1386342

SCHEMBL1386342

Nc1ncnc2cc(CN3CCN(Cc4cccc(-c5ccc(Cl)s5)c4)CC3=O)ccc12

nearest known ligand 0.61

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
F10 P00742 15/20 0.61
PDPK1 O15530 1/20 0.37
APP P05067 1/20 0.36
HRH3 Q9Y5N1 1/20 0.36
LIMK1 P53667 1/20 0.35
SLC2A1 P11166 1/20 0.35
PI4K2A Q9BTU6 1/20 0.34
F2 P00734 1/20 0.33

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
SCHEMBL1387023 0.95 F10 (0.64) F10PDPK1APPHRH3LIMK1
SCHEMBL4390958 0.87 F10 (0.63) F10PDPK1APPHRH3LIMK1
SCHEMBL1653302 0.87 F10 (0.59) F10PDPK1APPHRH3
SCHEMBL1651479 0.87 F10 (0.64) F10PDPK1
SCHEMBL4065113 0.84 F10 (0.60) F10
SCHEMBL1655301 0.84 F10 (0.66) F10PDPK1SLC2A1
SCHEMBL1385892 0.84 F10 (0.51) F10PDPK1
SCHEMBL1652606 0.84 F10 (0.69) F10APPHRH3LIMK1SLC2A1
SCHEMBL1652172 0.84 F10 (0.73) F10APPHRH3LIMK1
SCHEMBL4070203 0.84 F10 (0.61) F10PDPK1

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 6 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
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