SCHEMBL1386136

SCHEMBL1386136

CCC[C@H]1C(=O)N(Cc2cc3cnccc3[nH]2)CCN1Cc1ccc(-c2ccc(Cl)s2)s1

nearest known ligand 0.56

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
F10 P00742 12/20 0.56
F2 P00734 2/20 0.43
PRMT5 O14744 1/20 0.35
WDR77 Q9BQA1 1/20 0.35
KDM4E B2RXH2 1/20 0.33
ALDH1A1 P00352 1/20 0.33
LMNA P02545 1/20 0.33
NAMPT P43490 1/20 0.31

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
SCHEMBL1653330 0.91 F10 (0.56) F10F2PRMT5WDR77KDM4E
SCHEMBL1386675 0.90 F10 (0.51) F10F2PRMT5WDR77KDM4E
SCHEMBL1385551 0.90 F10 (0.54) F10F2PRMT5WDR77KDM4E
SCHEMBL1385552 0.90 F10 (0.54) F10F2PRMT5WDR77KDM4E
SCHEMBL1386737 0.88 F10 (0.52) F10F2PRMT5WDR77KDM4E
SCHEMBL1385962 0.88 F10 (0.52) F10F2PRMT5WDR77KDM4E
SCHEMBL1385600 0.87 F10 (0.51) F10F2PRMT5WDR77NAMPT
SCHEMBL1385601 0.87 F10 (0.51) F10F2PRMT5WDR77NAMPT
SCHEMBL1385003 0.86 F10 (0.50) F10F2PRMT5WDR77KDM4E
SCHEMBL1385786 0.83 F10 (0.58) F10F2PRMT5WDR77NAMPT

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