SCHEMBL3942789

SCHEMBL3942789

CC#CCOc1ccc(S(=O)(=O)N(C)C2CCCCC2C(=O)NO)cc1

nearest known ligand 0.59

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
ADAM17 P78536 18/20 0.59
MMP13 P45452 16/20 0.57
MMP1 P03956 14/20 0.57
MMP9 P14780 7/20 0.57
MMP2 P08253 1/20 0.57
MMP7 P09237 1/20 0.57
MMP8 P22894 1/20 0.57
MMP3 P08254 1/20 0.52

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
SCHEMBL3938831 1.00 ADAM17 (0.59) ADAM17MMP13MMP1MMP9MMP2
SCHEMBL3942784 1.00 ADAM17 (0.59) ADAM17MMP13MMP1MMP9MMP2
SCHEMBL3942787 1.00 ADAM17 (0.59) ADAM17MMP13MMP1MMP9MMP2
SCHEMBL4148426 0.98 ADAM17 (0.59) ADAM17MMP13MMP1MMP9MMP2
SCHEMBL7872221 0.89 ADAM17 (0.52) ADAM17MMP13MMP1MMP9MMP2
SCHEMBL7878258 0.89 ADAM17 (0.52) ADAM17MMP13MMP1MMP9MMP2
SCHEMBL7358605 0.89 ADAM17 (0.52) ADAM17MMP13MMP1MMP9MMP2
SCHEMBL7879791 0.87 ADAM17 (0.52) ADAM17MMP13MMP1MMP9MMP2
SCHEMBL3944455 0.80 ADAM17 (0.57) ADAM17MMP13MMP1MMP9MMP2
SCHEMBL3944450 0.80 ADAM17 (0.57) ADAM17MMP13MMP1MMP9MMP2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6326516-B1 RHEUMATIC DISEASES; SEPSIS; ANTIULCER AGENTS AMERICAN CYANAMID COMPANY 2001-12-04 US claimed
EP-1147078-A1 ACETYLENIC (BETA)-SULFONAMIDO AND PHOSPHINIC ACID AMIDE HYDROXAMIC ACID TACE INHIBITORS American Cyanamid Company (US) 2001-10-24 EP claimed
WO-2000044711-A1 ACETYLENIC $G(b)-SULFONAMIDO AND PHOSPHINIC ACID AMIDE HYDROXAMIC ACID TACE INHIBITORS AMERICAN CYANAMID COMPANY (US) 2000-08-03 WO claimed
US-7488754-B2 Method for the treatment of polycystic kidney disease WYETH (US) 2009-02-10 US disclosed
US-20040063672-A1 Method for the treatment of polycystic kidney disease WYETH HOLDINGS CORPORATION 2004-04-01 US disclosed
US-6326516-B1 RHEUMATIC DISEASES; SEPSIS; ANTIULCER AGENTS AMERICAN CYANAMID COMPANY 2001-12-04 US disclosed
EP-1147078-A1 ACETYLENIC (BETA)-SULFONAMIDO AND PHOSPHINIC ACID AMIDE HYDROXAMIC ACID TACE INHIBITORS American Cyanamid Company (US) 2001-10-24 EP disclosed
WO-2000044711-A1 ACETYLENIC $G(b)-SULFONAMIDO AND PHOSPHINIC ACID AMIDE HYDROXAMIC ACID TACE INHIBITORS AMERICAN CYANAMID COMPANY (US) 2000-08-03 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-20040063672-A1 Method for the treatment of polycystic kidney disease PKD1, PKD2, PCSK6 ADAM17 9/4885MMP13 246/4885MMP1 215/4885

“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.