SCHEMBL6500574

SCHEMBL6500574

CC#CCOc1ccc(S(=O)(=O)N2CCN(c3ccccc3)CCC2C(=O)O)cc1

nearest known ligand 0.62

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
MMP13 P45452 20/20 0.62
ADAM17 P78536 20/20 0.62
MMP1 P03956 19/20 0.62
MMP9 P14780 6/20 0.56

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
SCHEMBL6626726 0.85 ADAM17 (0.84) MMP13ADAM17MMP1MMP9
SCHEMBL6508443 0.85 MMP13 (0.84) MMP13ADAM17MMP1MMP9
SCHEMBL6506632 0.81 MMP13 (0.80) MMP13ADAM17MMP1MMP9
SCHEMBL6506359 0.81 MMP13 (0.71) MMP13ADAM17MMP1MMP9
SCHEMBL7442494 0.81 MMP13 (0.69) MMP13ADAM17MMP1MMP9
SCHEMBL6500455 0.80 MMP13 (0.82) MMP13ADAM17MMP1MMP9
SCHEMBL6501341 0.80 ADAM17 (0.64) MMP13ADAM17MMP1MMP9
SCHEMBL6506731 0.80 MMP13 (0.80) MMP13ADAM17MMP1MMP9
SCHEMBL7429732 0.79 MMP1 (0.62) MMP13ADAM17MMP1MMP9
SCHEMBL6506041 0.78 MMP13 (0.80) MMP13ADAM17MMP1MMP9

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-20050113346-A1 Acetylenic alpha-amino acid-based sulfonamide hydroxamic acid tace inhibitors WYETH HOLDINGS CORPORATION 2005-05-26 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-20050113346-A1 Acetylenic alpha-amino acid-based sulfonamide hydroxamic acid tace inhibitors TNF, SI, MMP12 MMP13 115/4885ADAM17 30/4885MMP1 203/4885

“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.