SCHEMBL6024306

SCHEMBL6024306

CCCCC[C@H](CN(O)C=O)C(=O)N(N)C(=O)[C@@H]1Cc2ccccc2CN1

nearest known ligand 0.42

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
BMP1 P13497 1/20 0.40
CXCR3 P49682 1/20 0.38
SMYD3 Q9H7B4 1/20 0.36
MEN1 O00255 1/20 0.36
KMT2A Q03164 1/20 0.36

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
SCHEMBL6024669 0.81 BMP1 (0.45) BMP1CXCR3MEN1KMT2A
SCHEMBL6023477 0.73 BMP1 (0.49) BMP1
SCHEMBL6024296 0.72 BMP1 (0.48) BMP1MEN1KMT2A
SCHEMBL6024265 0.71 BMP1 (0.41) BMP1MEN1KMT2A
SCHEMBL6023712 0.71 BMP1 (0.47) BMP1
SCHEMBL6023658 0.71 BMP1 (0.45) BMP1
SCHEMBL6023672 0.70 HTR1A (0.40) BMP1
SCHEMBL6023843 0.69 BMP1 (0.44) BMP1
SCHEMBL6024471 0.69 HDAC6 (0.46) BMP1MEN1KMT2A
SCHEMBL6023663 0.69 BMP1 (0.37) BMP1

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-1363873-A4 PEPTIDE DEFORMYLASE INHIBITORS SMITHKLINE BEECHAM CORP (US) 2006-01-04 EP claimed
EP-1363873-A2 PEPTIDE DEFORMYLASE INHIBITORS SmithKline Beecham Corporation (US) 2003-11-26 EP claimed
WO-2002070541-A2 PEPTIDE DEFORMYLASE INHIBITORS SMITH KLINE BEECHAM CORPORATION (US) 2002-09-12 WO claimed