SCHEMBL7373357

SCHEMBL7373357

CNC(=O)N(CCc1ccccc1)C(=O)[C@@H](CC(=O)NO)CC(C)C

nearest known ligand 0.57

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
MMP2 P08253 14/20 0.57
MMP1 P03956 12/20 0.57
MMP12 P39900 2/20 0.57
MMP13 P45452 2/20 0.57
MMP9 P14780 11/20 0.54
MMP3 P08254 8/20 0.54
MMP8 P22894 5/20 0.54
MMP7 P09237 4/20 0.54
FCER2 P06734 3/20 0.54
MMP14 P50281 5/20 0.50
LTA4H P09960 1/20 0.46
BIRC2 Q13490 1/20 0.45

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
SCHEMBL10424672 0.84 MMP2 (0.50) MMP2MMP1MMP12MMP13MMP9
SCHEMBL14068117 0.77 MMP2 (0.66) MMP2MMP1MMP12MMP13MMP9
SCHEMBL3842681 0.75 TAAR1 (0.48) MMP1MMP3
SCHEMBL8777260 0.75 MMP2 (0.55) MMP2MMP1MMP9MMP3MMP7
SCHEMBL10424074 0.75 MMP1 (0.51) MMP2MMP1MMP12MMP13MMP9
SCHEMBL29838142 0.73 MMP2 (1.00) MMP2MMP1MMP12MMP13MMP9
SCHEMBL4634581 0.73 MMP2 (1.00) MMP2MMP1MMP12MMP13MMP9
SCHEMBL4634587 0.73 MMP2 (1.00) MMP2MMP1MMP12MMP13MMP9
SCHEMBL4634577 0.73 MMP2 (1.00) MMP2MMP1MMP12MMP13MMP9
SCHEMBL7072801 0.73 MMP2 (0.56) MMP2MMP1MMP12MMP13MMP9

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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