SCHEMBL8197265

SCHEMBL8197265

CNC(=O)[C@H](NC(=O)N(O)C(=O)[C@@H](O)CCCCc1ccccc1)C(C)(C)SCc1ccccc1

nearest known ligand 0.45

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
MMP2 P08253 13/20 0.45
MMP3 P08254 12/20 0.45
MMP1 P03956 7/20 0.43
MMP9 P14780 3/20 0.43
MMP14 P50281 2/20 0.43
MMP13 P45452 2/20 0.38
MMP8 P22894 1/20 0.38
MMP12 P39900 1/20 0.38
MMP7 P09237 1/20 0.37

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
SCHEMBL8424487 0.86 MMP2 (0.41) MMP2MMP3MMP1MMP9MMP14
SCHEMBL8422729 0.81 MMP2 (0.43) MMP2MMP3MMP1MMP9MMP14
SCHEMBL8197789 0.81 MMP2 (0.39) MMP2MMP3MMP1MMP9MMP13
SCHEMBL8198041 0.79 MMP2 (0.39) MMP2MMP3MMP1MMP9MMP14
SCHEMBL8422672 0.78 GAA (0.39) MMP2MMP3MMP1MMP9MMP13
SCHEMBL8203109 0.77 MMP2 (0.53) MMP2MMP3MMP1MMP9MMP14
SCHEMBL8190215 0.76 MMP1 (0.40) MMP2MMP3MMP1MMP9MMP14
SCHEMBL7406988 0.75 MMP1 (0.43) MMP2MMP3MMP1MMP9MMP7
SCHEMBL27258950 0.74 MMP2 (0.44) MMP2MMP3MMP1MMP9MMP14
SCHEMBL8189876 0.74 MMP1 (0.43) MMP2MMP3MMP1MMP9MMP14

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0740655-B1 METALLOPROTEINASE INHIBITORS BRITISH BIOTECH PHARM (GB) 1999-10-20 EP claimed
EP-0740655-A1 METALLOPROTEINASE INHIBITORS BRITISH BIOTECH PHARMACEUTICALS LIMITED (GB) 1996-11-06 EP claimed
WO-1995019961-A1 METALLOPROTEINASE INHIBITORS BRITISH BIOTECH PHARMACEUTICALS LIMITED (GB) 1995-07-27 WO claimed
US-6017889-A Metalloproteinase inhibitors BRITISH BIOTECH PHARMACEUTICALS LIMITED (GB) 2000-01-25 US disclosed
EP-0740655-B1 METALLOPROTEINASE INHIBITORS BRITISH BIOTECH PHARM (GB) 1999-10-20 EP disclosed
EP-0740655-A1 METALLOPROTEINASE INHIBITORS BRITISH BIOTECH PHARMACEUTICALS LIMITED (GB) 1996-11-06 EP disclosed
WO-1995019961-A1 METALLOPROTEINASE INHIBITORS BRITISH BIOTECH PHARMACEUTICALS LIMITED (GB) 1995-07-27 WO disclosed