SCHEMBL1656181

SCHEMBL1656181

CCCC[Sn](CCCC)(CCCC)c1ccc(S(=O)(=O)NC(C(=O)OC(C)(C)C)C(C)C)cc1

nearest known ligand 0.41

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
ADAMTS4 O75173 4/20 0.41
MMP9 P14780 12/20 0.40
MMP2 P08253 12/20 0.39
MMP3 P08254 11/20 0.39
MMP13 P45452 11/20 0.39
MMP1 P03956 10/20 0.39
MMP7 P09237 10/20 0.39
MMP8 P22894 1/20 0.39
GAA P10253 1/20 0.38
MAPT P10636 1/20 0.38
HSD17B10 Q99714 1/20 0.38
MMP14 P50281 1/20 0.38

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
SCHEMBL13978713 0.83 ADAMTS4 (0.47) ADAMTS4MMP9MMP2MMP13GAA
SCHEMBL3615326 0.78 MMP2 (0.61) ADAMTS4MMP9MMP2MMP3MMP13
SCHEMBL14176097 0.78 MMP9 (0.47) ADAMTS4MMP9MMP2MMP3MMP13
SCHEMBL1656896 0.78 MMP2 (0.61) ADAMTS4MMP9MMP2MMP3MMP13
SCHEMBL8283236 0.78 MMP2 (0.61) ADAMTS4MMP9MMP2MMP3MMP13
SCHEMBL14419201 0.77 MMP9 (0.56) ADAMTS4MMP9MMP2MMP3MMP13
SCHEMBL10208755 0.77 ADAMTS4 (0.54) ADAMTS4MMP9MMP2MMP3MMP13
SCHEMBL10209982 0.77 ADAMTS4 (0.54) ADAMTS4MMP9MMP2MMP3MMP13
SCHEMBL7087648 0.77 MMP9 (0.64) ADAMTS4MMP9MMP2MMP3MMP13
SCHEMBL5093836 0.77 MMP9 (0.64) ADAMTS4MMP9MMP2MMP3MMP13

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7923446-B2 3-Methyl-2-[4'-(pyridin-3-ylmethoxymethyl)-biphenyl-4-sulfonylamino]-butyric acid; metalloproteinase inhibitors; arthritis, macular degeneration, graft versus host disease, cancer, osteoarthritis WYETH LLC (US) 2011-04-12 US disclosed
EP-1689380-A4 METHOD FOR TREATING ADAMTS-5-ASSOCIATED DISEASE WYETH CORP (US) 2009-03-18 EP disclosed
US-20080311113-A1 METHOD FOR TREATING ADAMTS-5-ASSOCIATED DISEASE WYETH (US) 2008-12-18 US disclosed
US-7390833-B2 Method for treating ADAMTS-5-associated disease WYETH (US) 2008-06-24 US disclosed
US-20070225327-A1 Biaryl Sulfonamides and Methods for Using Same WYETH (US) 2007-09-27 US disclosed
US-7268135-B2 Biaryl sulfonamides and methods for using same WYETH (US) 2007-09-11 US disclosed
EP-1689380-A2 METHOD FOR TREATING ADAMTS-5-ASSOCIATED DISEASE Wyeth (US) 2006-08-16 EP disclosed
EP-1689716-A1 BIARYL SULFONAMIDES AND METHODS FOR USING SAME Wyeth (US) 2006-08-16 EP disclosed
US-20060004066-A1 Method for treating ADAMTS-5-associated disease WYETH (US) 2006-01-05 US disclosed
WO-2005060456-A2 METHOD FOR TREATING ADAMTS-5-ASSOCIATE DISEASE WYETH (US) 2005-07-07 WO disclosed
WO-2005061459-A1 BIARYL SULFONAMIDES AND METHODS FOR USING SAME WYETH (US) 2005-07-07 WO disclosed
US-20050130973-A1 Biaryl sulfonamides and methods for using same WYETH (US) 2005-06-16 US 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 (4 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-20050130973-A1 Biaryl sulfonamides and methods for using same STS, MMP3, AADAC ADAMTS4 113/4885MMP9 14/4885MMP2 5/4885
US-20060004066-A1 Method for treating ADAMTS-5-associated disease ADAMTS5, ADAMTS1, ADAMTS4 ADAMTS4 3/4885MMP9 87/4885MMP2 119/4885
US-20080311113-A1 METHOD FOR TREATING ADAMTS-5-ASSOCIATED DISEASE ADAMTS5, ADAMTS1, ADAMTS4 ADAMTS4 3/4885MMP9 87/4885MMP2 119/4885
US-20070225327-A1 Biaryl Sulfonamides and Methods for Using Same STS, MMP3, AADAC ADAMTS4 113/4885MMP9 14/4885MMP2 5/4885

“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.