SCHEMBL7450983

SCHEMBL7450983

COCC#CCC(NS(=O)(=O)c1ccc(NC(=O)c2ccc(OC)cc2)cc1)C(=O)O

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
MMP2 P08253 16/20 1.00
MMP13 P45452 15/20 1.00
MMP3 P08254 12/20 1.00
MMP1 P03956 5/20 0.76
MMP9 P14780 3/20 0.62
LMNA P02545 1/20 0.62
MMP8 P22894 1/20 0.56
HSD17B10 Q99714 1/20 0.54

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
SCHEMBL7451546 0.92 MMP2 (0.85) MMP2MMP13MMP3MMP1MMP9
SCHEMBL7454871 0.91 MMP2 (1.00) MMP2MMP13MMP3MMP1MMP9
SCHEMBL7452549 0.90 MMP2 (0.82) MMP2MMP13MMP3MMP1MMP9
SCHEMBL7898480 0.90 MMP2 (1.00) MMP2MMP13MMP3MMP1MMP9
SCHEMBL7451531 0.87 MMP13 (0.80) MMP2MMP13MMP3MMP1MMP9
SCHEMBL4327772 0.87 MMP13 (1.00) MMP2MMP13MMP3MMP1MMP9
SCHEMBL7502924 0.87 MMP13 (1.00) MMP2MMP13MMP3MMP1MMP9
SCHEMBL7455660 0.84 MMP13 (0.73) MMP2MMP13MMP3MMP1MMP9
SCHEMBL7454899 0.84 MMP2 (0.88) MMP2MMP13MMP3MMP1MMP9
Pg-530742 SCHEMBL4382111 0.84 MMP2 (0.80) MMP2MMP13MMP3MMP1MMP9

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1165501-A1 ALKENYL- AND ALKYNYL-CONTAINING METALLOPROTEASE INHIBITORS THE PROCTER & GAMBLE COMPANY (US) 2002-01-02 EP disclosed
US-6197770-B1 ENZYME INHIBITORS; ANTIARTHRITIC AGENTS; BONE DISORDERS THE PROCTER & GAMBLE CO. 2001-03-06 US disclosed
WO-2000051975-A1 ALKENYL- AND ALKYNYL-CONTAINING METALLOPROTEASE INHIBITORS THE PROCTER & GAMBLE COMPANY (US) 2000-09-08 WO disclosed