SCHEMBL1658636

SCHEMBL1658636

COc1cc(COc2ccc(-c3ccc(S(=O)(=O)NC(C(=O)O)C(C)C)cc3)cc2OC)cc(OC)c1

nearest known ligand 0.68

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
ADAMTS4 O75173 18/20 0.68
MMP13 P45452 12/20 0.63
MMP9 P14780 2/20 0.63
MMP1 P03956 1/20 0.63
MMP2 P08253 1/20 0.63
MMP3 P08254 1/20 0.63
MMP7 P09237 1/20 0.63
MMP8 P22894 1/20 0.63

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
SCHEMBL8284057 1.00 ADAMTS4 (0.68) ADAMTS4MMP13MMP9MMP1MMP2
SCHEMBL1658488 0.89 ADAMTS4 (0.84) ADAMTS4MMP13MMP9MMP1MMP2
SCHEMBL8284841 0.89 ADAMTS4 (0.84) ADAMTS4MMP13MMP9MMP1MMP2
SCHEMBL1656194 0.87 ADAMTS4 (0.78) ADAMTS4MMP13
SCHEMBL8283969 0.87 ADAMTS4 (0.78) ADAMTS4MMP13
SCHEMBL28761655 0.86 ADAMTS4 (0.67) ADAMTS4MMP13MMP9MMP1MMP2
SCHEMBL8284043 0.83 ADAMTS4 (0.74) ADAMTS4MMP13MMP9MMP1MMP2
SCHEMBL28761657 0.82 ADAMTS4 (0.62) ADAMTS4MMP13MMP9MMP1MMP2
SCHEMBL8283258 0.81 ADAMTS4 (1.00) ADAMTS4MMP13MMP2
SCHEMBL1655672 0.81 ADAMTS4 (1.00) ADAMTS4MMP13MMP9MMP1MMP2

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 10 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
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
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 113/4885MMP13 13/4885MMP9 14/4885
US-20060004066-A1 Method for treating ADAMTS-5-associated disease ADAMTS5, ADAMTS1, ADAMTS4 ADAMTS4 3/4885MMP13 34/4885MMP9 87/4885
US-20080311113-A1 METHOD FOR TREATING ADAMTS-5-ASSOCIATED DISEASE ADAMTS5, ADAMTS1, ADAMTS4 ADAMTS4 3/4885MMP13 34/4885MMP9 87/4885
US-20070225327-A1 Biaryl Sulfonamides and Methods for Using Same STS, MMP3, AADAC ADAMTS4 113/4885MMP13 13/4885MMP9 14/4885

“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.