SCHEMBL6613733

SCHEMBL6613733

CCCCCC(=O)N1CC(C(=O)OC)N(S(=O)(=O)c2ccc(O)cc2)Cc2ccccc21

nearest known ligand 0.56

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
MMP1 P03956 17/20 0.56
MMP13 P45452 17/20 0.56
ADAM17 P78536 16/20 0.56
MMP9 P14780 16/20 0.56
MMP8 P22894 2/20 0.46
MMP3 P08254 2/20 0.46
MMP7 P09237 1/20 0.45

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
SCHEMBL6614372 0.92 MMP1 (0.67) MMP1MMP13ADAM17MMP9MMP8
SCHEMBL6639988 0.90 MMP1 (0.61) MMP1MMP13ADAM17MMP9
SCHEMBL6614392 0.88 MMP1 (0.72) MMP1MMP13ADAM17MMP9
SCHEMBL6612118 0.86 MMP1 (0.64) MMP1MMP13ADAM17MMP9MMP8
SCHEMBL6611144 0.85 MMP1 (0.58) MMP1MMP13ADAM17MMP9
SCHEMBL5655828 0.85 MMP1 (0.68) MMP1MMP13ADAM17MMP9
SCHEMBL6607928 0.85 MMP1 (0.57) MMP1MMP13ADAM17MMP9
SCHEMBL6612653 0.84 MMP1 (0.67) MMP1MMP13ADAM17MMP9MMP8
SCHEMBL27547259 0.83 MMP1 (0.79) MMP1MMP13ADAM17MMP9MMP8
SCHEMBL6612286 0.82 MMP1 (0.69) MMP1MMP13ADAM17MMP9

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