SCHEMBL4962145

SCHEMBL4962145

CCCCCC[C@H](CN(O)C=O)C(=O)N(N)c1nnc2ccccc2n1

nearest known ligand 0.45

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
BMP1 P13497 4/20 0.42
MMP12 P39900 1/20 0.39

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
SCHEMBL4962652 0.86 BMP1 (0.38) BMP1MMP12
SCHEMBL4591903 0.86 BMP1 (0.37) BMP1MMP12
SCHEMBL4591901 0.86 BMP1 (0.37) BMP1MMP12
SCHEMBL2782112 0.78 BMP1 (0.39) BMP1MMP12
SCHEMBL2782498 0.78 BMP1 (0.37) BMP1MMP12
SCHEMBL2782495 0.78 BMP1 (0.37) BMP1MMP12
SCHEMBL1596186 0.78 BMP1 (0.47) BMP1MMP12
SCHEMBL1596179 0.78 BMP1 (0.47) BMP1MMP12
SCHEMBL1595425 0.78
SCHEMBL1594840 0.77 BMP1 (0.48) BMP1MMP12

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1827449-A4 THE USE OF NOVEL ANTIBACTERIAL COMPOUNDS SMITHKLINE BEECHAM CORP (US) 2008-01-23 EP disclosed
EP-1827449-A2 THE USE OF NOVEL ANTIBACTERIAL COMPOUNDS SMITHKLINE BEECHAM CORPORATION (US) 2007-09-05 EP disclosed
WO-2006055663-A2 THE USE OF NOVEL ANTIBACTERIAL COMPOUNDS SMITHKLINE BEECHAM CORPORATION (US) 2006-05-26 WO disclosed