SCHEMBL4674873

SCHEMBL4674873

CN(C)C(=O)N1CCN(S(=O)(=O)N2CCN(c3ccc(F)cc3)C(=O)C2)[C@@H](C(=O)NO)C1

nearest known ligand 0.46

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
MMP1 P03956 11/20 0.40
MMP13 P45452 11/20 0.40
MMP3 P08254 10/20 0.40
MMP9 P14780 10/20 0.40
MMP7 P09237 9/20 0.40
HRH3 Q9Y5N1 1/20 0.39
ADAM17 P78536 1/20 0.37

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
SCHEMBL7453945 0.81 MMP13 (0.38) MMP1MMP13MMP3MMP9MMP7
SCHEMBL4674806 0.81 MMP13 (0.38) MMP1MMP13MMP3MMP9MMP7
SCHEMBL4673266 0.79 USP5 (0.41) MMP1MMP13MMP3MMP9MMP7
SCHEMBL7504893 0.78 MMP1 (0.39) MMP1MMP13MMP3MMP9MMP7
SCHEMBL4670994 0.78 MMP1 (0.39) MMP1MMP13MMP3MMP9MMP7
SCHEMBL4671560 0.77 LMNA (0.43) MMP1MMP13MMP3MMP9MMP7
SCHEMBL7447815 0.77 LMNA (0.43) MMP1MMP13MMP3MMP9MMP7
SCHEMBL4671377 0.74 MMP1 (0.47) MMP1MMP13MMP3MMP9MMP7
SCHEMBL7058805 0.72 MMP13 (0.43) MMP1MMP13MMP3MMP9MMP7
SCHEMBL4671384 0.70 HSD11B1 (0.47)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0958287-B2 SULFAMIDE-METALLOPROTEASE INHIBITORS HOFFMANN LA ROCHE (CH) 2008-04-09 EP disclosed
EP-0958287-B1 SULFAMIDE-METALLOPROTEASE INHIBITORS HOFFMANN LA ROCHE (CH) 2002-09-11 EP disclosed
US-6376506-B1 REACTING SULFAMOYL OXAZOLIDONE WITH (1,2,3,4)-TETRAHYDRO-BETA-CARBOLINE TO FORM INHIBITOR; USED TO TREAT ARTHRITIS, OSTEOPOROSIS, PERIODONTAL DISEASE, CARDIOVASCULAR DISEASES, MULTIPLE SCLEROSIS, AND TUMORS SYNTEX (U.S.A.) LLC 2002-04-23 US disclosed
US-6143744-A Sulfamide-metalloprotease inhibitors SYNTEX (U.S.A.) INC. (US) 2000-11-07 US disclosed
US-6130220-A ENZYME INHIBITORS SYNTEX (USA) INC. (US) 2000-10-10 US disclosed
US-5998412-A ANTIARTHRITIC AGENTS; OSTEOPOROSIS SYNTEX (U.S.A.) INC. (US) 1999-12-07 US disclosed
EP-0958287-A1 SULFAMIDE-METALLOPROTEASE INHIBITORS F. HOFFMANN-LA ROCHE AG (CH) 1999-11-24 EP disclosed
WO-1998032748-A1 SULFAMIDE-METALLOPROTEASE INHIBITORS F. HOFFMANN-LA ROCHE AG (CH) 1998-07-30 WO disclosed