SCHEMBL3606937

SCHEMBL3606937

COC(=O)C(NS(=O)(=O)c1ccc(-c2ccc(N)cn2)cc1)C(C)OC(C)(C)C

nearest known ligand 0.45

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
MMP2 P08253 11/20 0.45
MMP9 P14780 9/20 0.45
MMP13 P45452 7/20 0.45
MMP3 P08254 5/20 0.45
MMP1 P03956 4/20 0.45
MMP7 P09237 4/20 0.45
MMP8 P22894 1/20 0.39
ADAMTS4 O75173 4/20 0.37
SLC1A3 P43003 1/20 0.37
SLC1A2 P43004 1/20 0.37
SLC1A1 P43005 1/20 0.37
ALOX5AP P20292 2/20 0.37
FEN1 P39748 2/20 0.37
KEAP1 Q14145 1/20 0.37

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
SCHEMBL3617088 0.87 MMP2 (0.56) MMP2MMP9MMP13MMP3MMP1
SCHEMBL3608987 0.87 MMP2 (0.58) MMP2MMP9MMP13MMP3MMP1
SCHEMBL3620408 0.85 MMP9 (0.47) MMP2MMP9MMP13MMP3MMP1
SCHEMBL3614133 0.77 MMP2 (0.52) MMP2MMP9MMP13MMP3MMP1
SCHEMBL255126 0.73 MMP2 (0.67) MMP2MMP9MMP13MMP3MMP1
SCHEMBL3607214 0.73 MMP2 (0.75) MMP2MMP9MMP13MMP3MMP1
SCHEMBL1110927 0.73 MMP2 (0.75) MMP2MMP9MMP13MMP3MMP1
SCHEMBL1110930 0.73 MMP2 (0.75) MMP2MMP9MMP13MMP3MMP1
SCHEMBL3607260 0.72 MMP9 (0.58) MMP2MMP9MMP13MMP3MMP1
SCHEMBL3604512 0.70 CA1 (0.40) MMP2MMP9MMP13MMP3MMP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100137298-A1 Biaryl Sulfonamides and Methods for Using Same WYETH (US) 2010-06-03 US disclosed
EP-1692124-B1 BIARYL SULFONAMIDES AS MMP INHIBITORS WYETH CORP (US) 2008-10-15 EP disclosed
US-7420001-B2 Biaryl sulfonamides and methods for using same WYETH (US) 2008-09-02 US disclosed
EP-1692124-A1 BIARYL SULFONAMIDES AS MMP INHIBITORS Wyeth (US) 2006-08-23 EP disclosed
WO-2005061477-A1 BIARYL SULFONAMIDES AS MMP INHIBITORS WYETH (US) 2005-07-07 WO disclosed
US-20050143422-A1 Biaryl sulfonamides and methods for using same WYETH (US) 2005-06-30 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 (2 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-20100137298-A1 Biaryl Sulfonamides and Methods for Using Same STS, MMP3, AADAC MMP2 5/4885MMP9 14/4885MMP13 13/4885
US-20050143422-A1 Biaryl sulfonamides and methods for using same STS, MMP3, AADAC MMP2 5/4885MMP9 14/4885MMP13 13/4885

“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.