SCHEMBL6835855

SCHEMBL6835855

Cc1ccc(C#CC2=CCN(S(=O)(=O)CC3(C)NC(=O)NC3=O)CC2)cc1

nearest known ligand 0.44

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
MMP13 P45452 20/20 0.44
MMP14 P50281 10/20 0.44
MMP12 P39900 5/20 0.44

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
SCHEMBL942669 1.00 MMP13 (0.44) MMP13MMP14MMP12
SCHEMBL940852 0.91 MMP13 (0.53) MMP13MMP14MMP12
SCHEMBL2289321 0.86 MMP13 (0.43) MMP13MMP14MMP12
SCHEMBL5241113 0.86 MMP13 (0.43) MMP13MMP14MMP12
SCHEMBL5097147 0.85 MMP13 (0.44) MMP13MMP14MMP12
SCHEMBL8143638 0.85 MMP13 (0.41) MMP13MMP14MMP12
SCHEMBL5103259 0.84 MMP13 (0.48) MMP13MMP14MMP12
SCHEMBL5090731 0.84 MMP13 (0.44) MMP13MMP14MMP12
SCHEMBL5103261 0.84 MMP13 (0.48) MMP13MMP14MMP12
SCHEMBL5103016 0.84 MMP13 (0.44) MMP13MMP14MMP12

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20040147573-A1 Metalloproteinase inhibitors ASTRAZENECA AB (SE) 2004-07-29 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 (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-20040147573-A1 Metalloproteinase inhibitors MMP12, MMP7, MMP10 MMP13 19/4885MMP14 10/4885MMP12 1/4885

“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.