SCHEMBL4581332

SCHEMBL4581332

CCCCC[C@@H](CN(O)C=O)C(=O)N(N)C[C@H](O)CO

nearest known ligand 0.42

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
BMP1 P13497 6/20 0.38
PDF Q9HBH1 3/20 0.38
MMP12 P39900 1/20 0.34

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
SCHEMBL4581335 1.00 BMP1 (0.38) BMP1PDFMMP12
SCHEMBL4581327 1.00 BMP1 (0.38) BMP1PDFMMP12
SCHEMBL3900866 0.76 CA2 (0.50) BMP1
SCHEMBL3902711 0.76 CA2 (0.50) BMP1
SCHEMBL1597464 0.75 BMP1 (0.43) BMP1PDFMMP12
SCHEMBL1597465 0.75 BMP1 (0.43) BMP1PDFMMP12
SCHEMBL1597461 0.75 BMP1 (0.43) BMP1PDFMMP12
SCHEMBL4318257 0.74 GRIK1 (0.49) BMP1
SCHEMBL6023663 0.73 BMP1 (0.37) BMP1PDFMMP12
SCHEMBL6025846 0.73 BMP1 (0.37) BMP1PDF

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-1509218-A4 PEPTIDE DEFORMYLASE INHIBITORS SMITHKLINE BEECHAM CORP (US) 2008-03-26 EP disclosed
EP-1509218-A1 PEPTIDE DEFORMYLASE INHIBITORS SmithKline Beecham Corporation (US) 2005-03-02 EP disclosed
WO-2003101442-A1 PEPTIDE DEFORMYLASE INHIBITORS SMITHKLINE BEECHAM CORPORATION (US) 2003-12-11 WO disclosed