SCHEMBL7410230

SCHEMBL7410230

C=C(C)N(O)C(=O)C[C@@H](CC(C)C)C(=O)N[C@H](C(=O)Nc1ccc(O)cc1)C(C)(C)C

nearest known ligand 0.44

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
MMP3 P08254 12/20 0.44
MMP2 P08253 12/20 0.44
MMP1 P03956 10/20 0.44
MMP9 P14780 5/20 0.44
ADAM17 P78536 2/20 0.44
MMP13 P45452 2/20 0.44
MMP8 P22894 1/20 0.44
MMP14 P50281 1/20 0.44
MMP7 P09237 1/20 0.40

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
SCHEMBL7372625 0.91 MMP2 (0.51) MMP3MMP2MMP1MMP9ADAM17
SCHEMBL7368610 0.89 ANPEP (0.43) MMP3MMP2MMP1MMP9ADAM17
SCHEMBL7406850 0.89 MMP2 (0.50) MMP3MMP2MMP1MMP9ADAM17
SCHEMBL7372936 0.84 ADAM17 (0.43) MMP3MMP2MMP1MMP9ADAM17
SCHEMBL7372142 0.82 MMP3 (0.43) MMP3MMP2MMP1MMP9ADAM17
SCHEMBL8777469 0.82 MMP1 (0.49) MMP3MMP2MMP1MMP9ADAM17
SCHEMBL7411762 0.81 MMP1 (0.58) MMP3MMP2MMP1MMP9ADAM17
SCHEMBL7371930 0.79 HSPA5 (0.48) MMP3MMP2MMP1MMP9ADAM17
SCHEMBL8189738 0.78 MMP1 (0.47) MMP3MMP2MMP1MMP9ADAM17
SCHEMBL8777482 0.76 MMP3 (0.44) MMP3MMP2MMP1MMP9ADAM17

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0740652-B1 METALLOPROTEINASE INHIBITORS BRITISH BIOTECH PHARM (GB) 1998-05-06 EP claimed
EP-0740652-A1 METALLOPROTEINASE INHIBITORS BRITISH BIOTECH PHARMACEUTICALS LIMITED (GB) 1996-11-06 EP claimed
WO-1995019956-A1 METALLOPROTEINASE INHIBITORS BRITISH BIOTECH PHARMACEUTICALS LIMITED (GB) 1995-07-27 WO claimed
US-5919940-A TERT-LEUCINE-THIAZOL-2-YLAMIDE BRITISH BIOTECH PHARMACEUTICALS LIMITED (GB) 1999-07-06 US disclosed
US-5859253-A L-TERT-LEUCINE-2-PYRIDYLAMIDE BRITISH BIOTECH PHARMACEUTICALS LIMITED (GB) 1999-01-12 US disclosed
EP-0740652-B1 METALLOPROTEINASE INHIBITORS BRITISH BIOTECH PHARM (GB) 1998-05-06 EP disclosed
US-5747514-A Metalloproteinase inhibitors BRITISH BIOTECH PHARMACEUTICALS LIMITED (GB) 1998-05-05 US disclosed
EP-0740652-A1 METALLOPROTEINASE INHIBITORS BRITISH BIOTECH PHARMACEUTICALS LIMITED (GB) 1996-11-06 EP disclosed
WO-1995019956-A1 METALLOPROTEINASE INHIBITORS BRITISH BIOTECH PHARMACEUTICALS LIMITED (GB) 1995-07-27 WO disclosed