SCHEMBL6789714

SCHEMBL6789714

C#CCN1CCC(C(=O)O)(C(c2ccc(Oc3ccccc3)cc2)=S(=O)=O)CC1

nearest known ligand 0.50

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
MMP1 P03956 6/20 0.50
MMP13 P45452 7/20 0.42
MMP2 P08253 6/20 0.42
MMP9 P14780 5/20 0.42
MMP14 P50281 5/20 0.42
MMP3 P08254 4/20 0.42
MMP8 P22894 4/20 0.42
PARP10 Q53GL7 1/20 0.38
BCHE P06276 3/20 0.38
KDM2B Q8NHM5 3/20 0.38
HTT P42858 1/20 0.37
MAOB P27338 4/20 0.36
DRD2 P14416 1/20 0.36
SIGMAR1 Q99720 1/20 0.36

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
SCHEMBL6795694 0.90 MMP1 (0.59) MMP1MMP13MMP2MMP9MMP14
SCHEMBL7749955 0.88 MMP1 (0.46) MMP1MMP13MMP2MMP9MMP14
SCHEMBL6787429 0.83 MMP1 (0.50) MMP1MMP13MMP2MMP9MMP3
SCHEMBL6785881 0.78 MMP13 (0.49) MMP1MMP13MMP2MMP9MMP14
SCHEMBL6791949 0.78 MMP13 (0.39) MMP1MMP13MMP2MMP9MMP14
SCHEMBL7749979 0.73 MMP1 (0.59) MMP1MMP13MMP2MMP9MMP14
SCHEMBL6789708 0.72 MMP1 (0.81) MMP1MMP13MMP2MMP9MMP14
SCHEMBL6785767 0.72 KCNA3 (0.49) MMP1MMP13MMP2MMP9MMP3
SCHEMBL5919441 0.68 MMP13 (0.83) MMP1MMP13MMP2MMP9MMP14
SCHEMBL6795687 0.67 MMP1 (1.00) MMP1MMP13MMP2MMP9MMP14

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 10/4885MMP2 2/4885

“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.