SCHEMBL6615940

SCHEMBL6615940

COC(=O)C1CN(C(=O)C2CCCCC2)c2ccccc2CN1S(=O)(=O)c1ccc(OC)cc1

nearest known ligand 0.84

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
MMP1 P03956 18/20 0.84
MMP13 P45452 18/20 0.84
MMP9 P14780 17/20 0.84
ADAM17 P78536 17/20 0.84
MMP3 P08254 1/20 0.53
MMP7 P09237 1/20 0.53
USP2 O75604 1/20 0.48
ALDH1A1 P00352 1/20 0.48
LMNA P02545 1/20 0.48
GAA P10253 1/20 0.48
HPGD P15428 1/20 0.48
TSHR P16473 1/20 0.48

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
SCHEMBL6612539 0.97 MMP1 (0.79) MMP1MMP13MMP9ADAM17MMP3
SCHEMBL6609030 0.95 MMP1 (0.83) MMP1MMP13MMP9ADAM17USP2
SCHEMBL6613983 0.92 MMP1 (0.82) MMP1MMP13MMP9ADAM17MMP3
SCHEMBL6613527 0.89 MMP1 (0.77) MMP1MMP13MMP9ADAM17MMP3
SCHEMBL6612286 0.87 MMP1 (0.69) MMP1MMP13MMP9ADAM17
SCHEMBL6608451 0.87 MMP1 (0.81) MMP1MMP13MMP9ADAM17USP2
SCHEMBL5657799 0.87 MMP1 (0.82) MMP1MMP13MMP9ADAM17ALDH1A1
Dimethylamine SCHEMBL6642543 0.85 MMP1 (0.79) MMP1MMP13MMP9ADAM17ALDH1A1
SCHEMBL6648684 0.85 MMP13 (0.79) MMP1MMP13MMP9ADAM17
SCHEMBL5656287 0.84 MMP1 (0.83) MMP1MMP13MMP9ADAM17MMP3

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