SCHEMBL7325403

SCHEMBL7325403

CN(C)C(=O)N1CCN(S(=O)(=O)N2CC=C(c3ccc(Cl)cc3)CC2)[C@@H](C(=O)NO)C1

nearest known ligand 0.42

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
MMP14 P50281 1/20 0.42
ADAMTS5 Q9UNA0 1/20 0.42
MMP3 P08254 9/20 0.39
MMP2 P08253 2/20 0.39
MMP1 P03956 6/20 0.39
MMP13 P45452 6/20 0.39
MMP7 P09237 5/20 0.39
MMP9 P14780 5/20 0.39
CCR1 P32246 1/20 0.38
MMP8 P22894 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
SCHEMBL4671560 0.91 LMNA (0.43) MMP3MMP2MMP1MMP13MMP7
SCHEMBL7447815 0.91 LMNA (0.43) MMP3MMP2MMP1MMP13MMP7
SCHEMBL4675047 0.81 MMP1 (0.48) MMP14ADAMTS5MMP3MMP2MMP1
SCHEMBL8149255 0.81 MMP1 (0.47) MMP3MMP2MMP1MMP13MMP7
SCHEMBL4674327 0.80 LMNA (0.45) MMP3MMP2
SCHEMBL4674332 0.80 LMNA (0.45) MMP3MMP2
SCHEMBL7508099 0.79 LMNA (0.51)
SCHEMBL4672936 0.79 LMNA (0.51)
SCHEMBL4671223 0.79 LMNA (0.44)
SCHEMBL4676634 0.79 LMNA (0.43) MMP3MMP2MMP1MMP13MMP7

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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