SCHEMBL7411892

SCHEMBL7411892

CC(CC[C@H](O)C(=O)N(O)C(=O)N[C@H](C(=O)Nc1ccccc1)C(C)(C)C)c1ccccc1

nearest known ligand 0.44

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
MMP2 P08253 15/20 0.44
MMP3 P08254 10/20 0.44
MMP1 P03956 2/20 0.40
MTOR P42345 1/20 0.40
TNF P01375 1/20 0.37
ADAM17 P78536 1/20 0.37
POLB P06746 1/20 0.36
HSD17B10 Q99714 1/20 0.36
KLK7 P49862 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
SCHEMBL7410121 0.90 MMP2 (0.47) MMP2MMP3MMP1POLB
SCHEMBL7370348 0.80 MMP2 (0.46) MMP2MMP3MMP1
SCHEMBL7371393 0.79 RAB9A (0.43) MMP2MMP3ADAM17
SCHEMBL7411915 0.75 MMP2 (0.49) MMP2MMP3MMP1POLB
SCHEMBL8197269 0.74 MMP1 (0.42) MMP2MMP3MMP1TNFADAM17
SCHEMBL8197822 0.74 MMP1 (0.42) MMP2MMP3MMP1TNFADAM17
SCHEMBL8028148 0.74 MMP1 (0.52) MMP2MMP3MMP1POLB
SCHEMBL7513209 0.74 MMP1 (0.44) MMP2MMP3MMP1TNFADAM17
SCHEMBL7401014 0.72 MMP2 (0.47) MMP2MMP3MMP1TNFADAM17
SCHEMBL8026129 0.72 MMP3 (0.40) MMP2MMP3MMP1TNFADAM17

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