SCHEMBL7864111

SCHEMBL7864111

CC(C)C(NS(=O)(=O)c1ccc(-c2cccc(Br)c2)cc1)C(=O)O

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
MMP2 P08253 11/20 1.00
MMP13 P45452 11/20 1.00
MMP3 P08254 10/20 1.00
MMP1 P03956 9/20 1.00
MMP7 P09237 9/20 1.00
MMP9 P14780 9/20 1.00
MMP14 P50281 1/20 0.76
ADAMTS4 O75173 9/20 0.76

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
SCHEMBL7409278 1.00 MMP2 (1.00) MMP2MMP13MMP3MMP1MMP7
SCHEMBL4424095 0.87 MMP2 (1.00) MMP2MMP13MMP3MMP1MMP7
SCHEMBL7404078 0.87 MMP2 (1.00) MMP2MMP13MMP3MMP1MMP7
SCHEMBL4433724 0.87 MMP2 (1.00) MMP2MMP13MMP3MMP1MMP7
SCHEMBL1750956 0.87 MMP2 (1.00) MMP2MMP13MMP3MMP1MMP7
SCHEMBL4653257 0.87 MMP2 (1.00) MMP2MMP13MMP3MMP1MMP7
SCHEMBL32691806 0.87 MMP2 (1.00) MMP2MMP13MMP3MMP1MMP7
SCHEMBL7404221 0.85 MMP13 (1.00) MMP2MMP13MMP3MMP1MMP7
SCHEMBL7404225 0.85 MMP13 (1.00) MMP2MMP13MMP3MMP1MMP7
SCHEMBL7399706 0.85 MMP2 (0.76) MMP2MMP13MMP3MMP1MMP7

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0901466-B1 BIPHENYLSULFONAMIDE MATRIX METALLOPROTEINASE INHIBITORS WARNER LAMBERT CO (US) 2001-10-31 EP claimed
CN-1310629-A Combined administration of ACAT and MMP inhibitors for the treatment of atherosclerotic lesions WARNER LAMBERT CO (US) 2001-08-29 CN claimed
US-5756545-A ANTIARTHRITIC AGENTS; OSTEOPOROSIS WARNER-LAMBERT COMPANY (US) 1998-05-26 US claimed
EP-0901466-B1 BIPHENYLSULFONAMIDE MATRIX METALLOPROTEINASE INHIBITORS WARNER LAMBERT CO (US) 2001-10-31 EP disclosed
US-5756545-A ANTIARTHRITIC AGENTS; OSTEOPOROSIS WARNER-LAMBERT COMPANY (US) 1998-05-26 US disclosed