SCHEMBL6791022

SCHEMBL6791022

COc1cccc(CN2CCC(CS(=O)(=O)c3ccc(Oc4ccccc4)cc3)(C(=O)NO)CC2)c1

nearest known ligand 0.71

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
MMP1 P03956 15/20 0.71
MMP13 P45452 14/20 0.71
MMP9 P14780 13/20 0.71
MMP2 P08253 6/20 0.71
MMP3 P08254 3/20 0.71
ADAM17 P78536 13/20 0.66
MMP14 P50281 4/20 0.54
MMP8 P22894 2/20 0.54
ADAMTS4 O75173 1/20 0.54
MMP7 P09237 1/20 0.54
ADAMTS5 Q9UNA0 1/20 0.54
L3MBTL1 Q9Y468 1/20 0.52
FAAH O00519 2/20 0.51

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
SCHEMBL6789202 0.83 MMP13 (1.00) MMP1MMP13MMP9MMP2MMP3
SCHEMBL6795687 0.79 MMP1 (1.00) MMP1MMP13MMP9MMP2MMP3
SCHEMBL6567133 0.79 MMP1 (1.00) MMP1MMP13MMP9ADAM17
SCHEMBL6263670 0.79 MMP2 (0.84) MMP1MMP13MMP9MMP2ADAM17
SCHEMBL7751801 0.78 MMP1 (0.47) MMP1MMP13MMP9MMP2MMP3
SCHEMBL6788797 0.76 MMP13 (0.71) MMP1MMP13MMP9MMP2MMP3
SCHEMBL6790716 0.75 MMP1 (0.66) MMP1MMP13MMP9MMP2MMP3
SCHEMBL7306093 0.75 MMP1 (0.81) MMP1MMP13MMP9MMP2MMP3
SCHEMBL6790632 0.75 MEN1 (0.53) MMP1MMP13MMP9MMP2MMP3
SCHEMBL8000446 0.75 MMP9 (0.84) MMP1MMP13MMP9MMP2MMP3

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
US-20040097487-A1 Aromatic sulfonyl alpha-cycloamino hydroxamic acid compounds G.D. SEARLE & CO. 2004-05-20 US disclosed
US-6638952-B1 Matrix metalloprotease inhibitors PHARMACIA CORPORATION 2003-10-28 US disclosed
EP-0983257-A4 AROMATIC SULFONYL ALPHA-CYCLOAMINO HYDROXAMIC ACID COMPOUNDS MONSANTO CO (US) 2001-05-02 EP disclosed
EP-0983257-A1 AROMATIC SULFONYL ALPHA-CYCLOAMINO HYDROXAMIC ACID COMPOUNDS Monsanto Company (US) 2000-03-08 EP disclosed
WO-1998039315-A1 AROMATIC SULFONYL ALPHA-CYCLOAMINO 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-20040097487-A1 Aromatic sulfonyl alpha-cycloamino hydroxamic acid compounds MMP1, MMP2, MMP10 MMP1 1/4885MMP13 10/4885MMP9 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.