SCHEMBL6609517

SCHEMBL6609517

COC(=O)C1CN(C(=O)c2ccco2)c2ccccc2CN1S(=O)(=O)c1ccc(O)cc1

nearest known ligand 0.62

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
MMP1 P03956 19/20 0.62
MMP13 P45452 19/20 0.62
ADAM17 P78536 18/20 0.62
MMP9 P14780 17/20 0.53
ALDH1A1 P00352 1/20 0.47
NPSR1 Q6W5P4 1/20 0.47
MMP3 P08254 1/20 0.46
MMP7 P09237 1/20 0.46

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
SCHEMBL6608294 0.92 MMP1 (0.65) MMP1MMP13ADAM17MMP9MMP3
SCHEMBL6612542 0.88 MMP1 (0.51) MMP1MMP13ADAM17MMP9ALDH1A1
SCHEMBL5666010 0.86 MMP1 (0.69) MMP1MMP13ADAM17MMP9
SCHEMBL6613653 0.86 MMP1 (0.51) MMP1MMP13ADAM17MMP9
SCHEMBL6608563 0.86 MMP1 (0.51) MMP1MMP13ADAM17MMP9
SCHEMBL6609922 0.85 MMP13 (0.85) MMP1MMP13ADAM17MMP9
SCHEMBL6610709 0.85 MMP1 (0.56) MMP1MMP13ADAM17MMP9
SCHEMBL6609782 0.85 MMP13 (0.74) MMP1MMP13ADAM17MMP9
SCHEMBL5655828 0.85 MMP1 (0.68) MMP1MMP13ADAM17MMP9ALDH1A1
SCHEMBL6607898 0.84 MMP1 (0.64) MMP1MMP13ADAM17MMP9ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1147095-B1 2, 3, 4, 5-TETRAHYDRO-1H-[1, 4] BENZODIAZEPINE-3-HYDROXAMIC ACIDS AS MATRIX METALLOPROTEINASE INHIBITORS WYETH CORP (US) 2004-08-11 EP disclosed
US-6544984-B1 Treating disease conditions mediated by matrix metalloproteinases and TACE, such as tumor growth, osteoarthritis, rheumatoid arthritis and degenerative cartilage loss. AMERICAN CYANAMID COMPANY 2003-04-08 US disclosed
EP-1147095-A1 2, 3, 4, 5-TETRAHYDRO-1H-[1, 4] BENZODIAZEPINE-3-HYDROXAMIC ACIDS AS MATRIX METALLOPROTEINASE INHIBITORS American Cyanamid Company (US) 2001-10-24 EP disclosed
EP-1051407-A1 2,3,4,5-TETRAHYDRO-1H-[1,4]-BENZODIAZEPINE-3-HYDROXAMIC ACIDS AS MATRIX METALLOPROTEINASE INHIBITORS American Cyanamid Company (US) 2000-11-15 EP disclosed
WO-2000044730-A1 2,3,4,5-TETRAHYDRO-1H-[1,4]BENZODIAZEPINE-3-HYDROXAMIC ACID AS MATRIX METALLOPROTEINASE INHIBITORS AMERICAN CYANAMID COMPANY (US) 2000-08-03 WO disclosed
US-6071903-A ENZYME INHIBITORS OF MATRIX METALLOPROTEINASES (MMPS); ANTITUMOR,-CARCINOGENIC AND -ARTHRITIC AGENTS; OSTEOARTHRITIS; RHEUMATOID DISEASES; DEGENERATIVE CARTILAGE LOSS; LONG-ACTING, ORALLY BIOAVAILABLE NONPEPTIDE INHIBITORS AMERICAN CYANAMID COMPANY (US) 2000-06-06 US disclosed
WO-1999037625-A1 2,3,4,5-TETRAHYDRO-1H-[1,4]-BENZODIAZEPINE-3-HYDROXAMIC ACIDS AS MATRIX METALLOPROTEINASE INHIBITORS AMERICAN CYANAMID COMPANY (US) 1999-07-29 WO disclosed