SCHEMBL5655796

SCHEMBL5655796

COC(=O)C(CO)N(Cc1ccccc1N)S(=O)(=O)c1ccc(OC)cc1

nearest known ligand 0.56

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
KEAP1 Q14145 5/20 0.56
NFE2L2 Q16236 2/20 0.56
MMP8 P22894 6/20 0.50
MMP13 P45452 6/20 0.50
MMP1 P03956 2/20 0.50
MMP7 P09237 1/20 0.50
MMP12 P39900 1/20 0.50
BMP1 P13497 7/20 0.49
MMP2 P08253 5/20 0.49
MMP9 P14780 5/20 0.49
TAS2R14 Q9NYV8 1/20 0.44

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
SCHEMBL8023076 0.91 KEAP1 (0.46) KEAP1NFE2L2MMP8MMP13MMP1
SCHEMBL6608765 0.90 KEAP1 (0.64) KEAP1NFE2L2MMP8MMP13MMP1
SCHEMBL7389789 0.89 KEAP1 (0.44) KEAP1NFE2L2MMP8MMP13MMP1
SCHEMBL6610164 0.88 BMP1 (0.48) KEAP1NFE2L2MMP8MMP13MMP1
SCHEMBL6609943 0.86 MMP1 (0.47) KEAP1NFE2L2MMP8MMP13MMP1
SCHEMBL6613444 0.85 KEAP1 (0.53) KEAP1NFE2L2MMP8MMP13MMP1
SCHEMBL5654237 0.85 MMP1 (0.69) KEAP1NFE2L2MMP8MMP13MMP1
SCHEMBL6609503 0.82 BMP1 (0.52) KEAP1NFE2L2MMP8MMP13MMP1
Anisole SCHEMBL27490678 0.81 KEAP1 (0.40) KEAP1NFE2L2MMP8MMP13MMP1
SCHEMBL6609435 0.80 KEAP1 (0.60) KEAP1NFE2L2MMP8MMP13MMP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7282496-B2 Allenic aryl sulfonamide hydroxamic acids as matrix metalloproteinase and TACE inhibitors WYETH HOLDINGS CORPORATION (US) 2007-10-16 US disclosed
US-7282496-B2 Allenic aryl sulfonamide hydroxamic acids as matrix metalloproteinase and TACE inhibitors WYETH HOLDINGS CORPORATION (US) 2007-10-16 US disclosed
US-7282496-B2 Allenic aryl sulfonamide hydroxamic acids as matrix metalloproteinase and TACE inhibitors WYETH HOLDINGS CORPORATION (US) 2007-10-16 US disclosed
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
EP-1440057-A1 ALLENIC ARYL SULFONAMIDE HYDROXAMIC ACIDS AS MATRIX METALLOPROTEINASE AND TACE INHIBITORS Wyeth Holdings Corporation (US) 2004-07-28 EP disclosed
US-20030130238-A1 Allenic aryl sulfonamide hydroxamic acids as matrix metalloproteinase and tace inhibitors AMERICAN CYANAMID COMPANY (US) 2003-07-10 US disclosed
US-20030130238-A1 Allenic aryl sulfonamide hydroxamic acids as matrix metalloproteinase and tace inhibitors AMERICAN CYANAMID COMPANY (US) 2003-07-10 US disclosed
US-20030130238-A1 Allenic aryl sulfonamide hydroxamic acids as matrix metalloproteinase and tace inhibitors AMERICAN CYANAMID COMPANY (US) 2003-07-10 US disclosed
WO-2003037852-A1 ALLENIC ARYL SULFONAMIDE HYDROXAMIC ACIDS AS MATRIX METALLOPROTEINASE AND TACE INHIBITORS WYETH HOLDINGS CORPORATION (US) 2003-05-08 WO 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

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20030130238-A1 Allenic aryl sulfonamide hydroxamic acids as matrix metalloproteinase and tace inhibitors MMP12, MMP1, SI KEAP1 1805/4885NFE2L2 1978/4885MMP8 53/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.