SCHEMBL7040196

SCHEMBL7040196

CC#CCOc1ccc(S(=O)(=O)C2(C(=O)NO)CCN(C(=O)OC(C)(C)C)CC2)cc1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
ADAM17 P78536 18/20 1.00
MMP13 P45452 17/20 1.00
MMP1 P03956 6/20 0.66
MMP9 P14780 5/20 0.66
MMP2 P08253 6/20 0.65
MMP14 P50281 4/20 0.65

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
SCHEMBL6268117 0.90 ADAM17 (0.81) ADAM17MMP13MMP1MMP9MMP2
SCHEMBL5666020 0.90 ADAM17 (0.81) ADAM17MMP13MMP1MMP9MMP2
SCHEMBL3946118 0.89 ADAM17 (0.80) ADAM17MMP13MMP1MMP9MMP2
SCHEMBL7427317 0.88 ADAM17 (0.79) ADAM17MMP13MMP1MMP9MMP2
SCHEMBL6266622 0.88 ADAM17 (0.85) ADAM17MMP13MMP1MMP9MMP2
SCHEMBL6267535 0.86 ADAM17 (0.76) ADAM17MMP13MMP1MMP9MMP2
SCHEMBL6268180 0.86 ADAM17 (0.75) ADAM17MMP13MMP1MMP9MMP2
SCHEMBL3942616 0.86 ADAM17 (0.82) ADAM17MMP13MMP1MMP9MMP2
SCHEMBL6507094 0.85 ADAM17 (0.75) ADAM17MMP13MMP1MMP9MMP2
SCHEMBL3946150 0.85 ADAM17 (1.00) ADAM17MMP13MMP1MMP9MMP2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20040229924-A1 Alkynyl containing hydroxamic acid compounds as matrix metalloproteinase/TACE inhibitors WYETH 2004-11-18 US disclosed
US-6753337-B2 INHIBITORS OF TNF-ALPHA CONVERTING ENZYME; TREATMENT OF ARTHRITIS, INFLAMMATION, INFLAMMATORY BOWEL DISEASE ETC, WYETH HOLDINGS CORPORATION 2004-06-22 US disclosed
US-20020086890-A1 Alkynyl containing hydroxamic acid compounds as matrix metalloproteinase/tace inhibitors AMERICAN CYANAMID COMPANY 2002-07-04 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 (2 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-20020086890-A1 Alkynyl containing hydroxamic acid compounds as matrix metalloproteinase/tace inhibitors MMP17, MMP1, MMP9 ADAM17 12/4885MMP13 16/4885MMP1 2/4885
US-20040229924-A1 Alkynyl containing hydroxamic acid compounds as matrix metalloproteinase/TACE inhibitors MMP17, MMP1, MMP9 ADAM17 12/4885MMP13 16/4885MMP1 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.