SCHEMBL6500975

SCHEMBL6500975

CC1(C)SCCN(S(=O)(=O)c2ccc(OCC#CCCBr)cc2)C1(C)C(N)=O

nearest known ligand 0.51

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
MMP1 P03956 20/20 0.51
ADAM17 P78536 20/20 0.51
MMP13 P45452 19/20 0.51
MMP9 P14780 3/20 0.47
ADAM10 O14672 2/20 0.47
MMP3 P08254 2/20 0.47
ADAM9 Q13443 2/20 0.47
MMP2 P08253 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
SCHEMBL6754086 0.81 MMP1 (0.58) MMP1ADAM17MMP13MMP9ADAM10
SCHEMBL7440416 0.80 MMP1 (0.59) MMP1ADAM17MMP13MMP9ADAM10
SCHEMBL5814098 0.80 MMP1 (0.56) MMP1ADAM17MMP13MMP9ADAM10
SCHEMBL6756489 0.77 CA12 (0.48) MMP1ADAM17MMP13MMP9ADAM10
SCHEMBL6501396 0.76 MMP1 (0.67) MMP1ADAM17MMP13MMP9ADAM10
SCHEMBL7079076 0.76 MMP1 (0.45) MMP1ADAM17MMP13MMP9ADAM10
SCHEMBL6501047 0.76 MMP1 (0.67) MMP1ADAM17MMP13MMP9ADAM10
SCHEMBL6500973 0.75 MMP1 (0.74) MMP1ADAM17MMP13MMP9ADAM10
SCHEMBL6756495 0.74 MMP1 (0.68) MMP1ADAM17MMP13MMP9ADAM10
SCHEMBL6757484 0.73 MMP1 (0.57) MMP1ADAM17MMP13MMP9ADAM10

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 MMP1 203/4885ADAM17 30/4885MMP13 115/4885

“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.