SCHEMBL7597125

SCHEMBL7597125

C=C(C)N(O)C(=O)C[C@@H](CC(C)C)C(=O)N[C@@H](C(=O)NC)C(C)(C)SCC1CCCCC1

nearest known ligand 0.41

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
MMP1 P03956 15/20 0.41
MMP3 P08254 9/20 0.41
MMP9 P14780 8/20 0.41
MMP2 P08253 6/20 0.41
ADAM17 P78536 5/20 0.41
MMP8 P22894 3/20 0.41
MMP13 P45452 3/20 0.41
MMP14 P50281 2/20 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
SCHEMBL7600843 0.82 MMP1 (0.48) MMP1MMP3MMP9MMP2ADAM17
SCHEMBL7597487 0.79 MMP1 (0.46) MMP1MMP3MMP9MMP2ADAM17
SCHEMBL7596890 0.78 MMP1 (0.52) MMP1MMP3MMP9MMP2ADAM17
SCHEMBL7595499 0.78 MMP1 (0.47) MMP1MMP3MMP9MMP2ADAM17
SCHEMBL8777489 0.77 MMP2 (0.46) MMP1MMP3MMP9MMP2ADAM17
SCHEMBL8189622 0.76 MMP3 (0.47) MMP1MMP3MMP9MMP2ADAM17
SCHEMBL8197037 0.76 MMP3 (0.47) MMP1MMP3MMP9MMP2ADAM17
SCHEMBL7595045 0.75 MMP1 (0.46) MMP1MMP3MMP9MMP2ADAM17
SCHEMBL8777469 0.74 MMP1 (0.49) MMP1MMP3MMP9MMP2ADAM17
SCHEMBL8189738 0.72 MMP1 (0.47) MMP1MMP3MMP9MMP2ADAM17

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-0905126-B1 Metalloproteinase inhibitors BRITISH BIOTECH PHARM (GB) 2002-12-04 EP claimed
EP-0905126-A1 Metalloproteinase inhibitors BRITISH BIOTECH PHARMACEUTICALS LIMITED (GB) 1999-03-31 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
EP-0905126-B1 Metalloproteinase inhibitors BRITISH BIOTECH PHARM (GB) 2002-12-04 EP disclosed
US-6017889-A Metalloproteinase inhibitors BRITISH BIOTECH PHARMACEUTICALS LIMITED (GB) 2000-01-25 US disclosed
EP-0905126-A1 Metalloproteinase inhibitors BRITISH BIOTECH PHARMACEUTICALS LIMITED (GB) 1999-03-31 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