SCHEMBL6135669

SCHEMBL6135669

CCCCC(CN(O)C=O)C(=O)NC(CC(=O)N(C)C)C(=O)OCc1ccccc1

nearest known ligand 0.47

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
BMP1 P13497 4/20 0.47
BIRC2 Q13490 1/20 0.43
CTSL P07711 1/20 0.43
CTSS P25774 1/20 0.43
MME P08473 1/20 0.42
ECE1 P42892 1/20 0.42
MMP2 P08253 5/20 0.41
MMP1 P03956 2/20 0.41
MMP3 P08254 1/20 0.41

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
SCHEMBL6135674 1.00 BMP1 (0.47) BMP1BIRC2CTSLCTSSMME
SCHEMBL7114508 0.89 BIRC2 (0.52) BMP1BIRC2MMEECE1MMP2
SCHEMBL7114506 0.89 BIRC2 (0.52) BMP1BIRC2MMEECE1MMP2
SCHEMBL6135650 0.84 MEN1 (0.50) BMP1BIRC2CTSLCTSSMME
SCHEMBL7084246 0.84 BIRC2 (0.53) BMP1BIRC2MMP2MMP1MMP3
SCHEMBL7118008 0.84 BIRC2 (0.53) BMP1BIRC2MMP2MMP1MMP3
SCHEMBL7116705 0.83 MMP2 (0.49) BMP1MMP2MMP3
SCHEMBL7116708 0.83 MMP2 (0.49) BMP1MMP2MMP3
SCHEMBL14282135 0.81 BMP1 (0.52) BMP1BIRC2MMP2MMP1MMP3
SCHEMBL7118243 0.81 BIRC2 (0.62) BMP1BIRC2MMP2MMP1MMP3

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
US-6908911-B1 Antibacterial agents BRITISH BIOTECH PHARMACEUTICALS LIMITED (GB) 2005-06-21 US claimed
EP-1210330-B1 ANTIBACTERIAL AGENTS VERNALIS OXFORD LTD (GB) 2005-04-20 EP claimed
US-6908911-B1 Antibacterial agents BRITISH BIOTECH PHARMACEUTICALS LIMITED (GB) 2005-06-21 US disclosed
EP-1210330-B1 ANTIBACTERIAL AGENTS VERNALIS OXFORD LTD (GB) 2005-04-20 EP disclosed