SCHEMBL6798909

SCHEMBL6798909

C[C@@H](NS(=O)(=O)c1ccc(Sc2ccccc2)cc1)C(=O)O

nearest known ligand 0.70

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
ADAMTS4 O75173 2/20 0.70
MMP13 P45452 9/20 0.58
MMP2 P08253 6/20 0.58
MMP9 P14780 4/20 0.58
MMP3 P08254 3/20 0.58
MMP1 P03956 3/20 0.58
MMP7 P09237 2/20 0.58
ALDH1A1 P00352 2/20 0.51
HSD17B10 Q99714 1/20 0.50
L3MBTL1 Q9Y468 1/20 0.50
GAA P10253 1/20 0.46
HTT P42858 1/20 0.46
GFER P55789 1/20 0.45

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
SCHEMBL6793899 0.90 ADAMTS4 (0.60) ADAMTS4MMP13MMP2MMP9MMP3
SCHEMBL702794 0.85 ADAMTS4 (0.81) ADAMTS4MMP13MMP2MMP9MMP3
SCHEMBL790069 0.85 ADAMTS4 (0.81) ADAMTS4MMP13MMP2MMP9MMP3
SCHEMBL702793 0.85 ADAMTS4 (0.81) ADAMTS4MMP13MMP2MMP9MMP3
SCHEMBL6797440 0.85 MMP2 (0.72) ADAMTS4MMP13MMP2MMP9MMP3
SCHEMBL4651862 0.83 ADAMTS4 (1.00) ADAMTS4MMP13MMP2MMP9MMP3
SCHEMBL1751961 0.83 ADAMTS4 (1.00) ADAMTS4MMP13MMP2MMP9MMP3
SCHEMBL6796513 0.83 MMP13 (0.50) ADAMTS4MMP13MMP2MMP9MMP3
SCHEMBL698907 0.79 ADAMTS4 (0.71) ADAMTS4MMP13MMP2MMP9MMP3
SCHEMBL4975578 0.79 ADAMTS4 (0.71) ADAMTS4MMP13MMP2MMP9MMP3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0977745-B1 THIOARYL SULFONAMIDE HYDROXAMIC ACID COMPOUNDS PHARMACIA CORP (US) 2004-12-01 EP disclosed
US-20040034071-A1 Thioaryl sulfonamide hydroxamic acid compounds PHARMACIA CORPORATION 2004-02-19 US disclosed
US-6087359-A A MATRIX METALLOPROTEASE ENZYME INHIBITOR PHARMACIA CORPORATION 2000-07-11 US disclosed
EP-0977745-A1 THIOARYL SULFONAMIDE HYDROXAMIC ACID COMPOUNDS MONSANTO COMPANY (US) 2000-02-09 EP disclosed
WO-1998039313-A1 THIOARYL SULFONAMIDE HYDROXAMIC ACID COMPOUNDS MONSANTO COMPANY (US) 1998-09-11 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-20040034071-A1 Thioaryl sulfonamide hydroxamic acid compounds MMP10, MMP1, MMP3 ADAMTS4 21/4885MMP13 11/4885MMP2 4/4885

“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.