SCHEMBL6659751

SCHEMBL6659751

CC#CCOc1ccc(S(=O)(=O)C(C)(Cc2ccc(OCCN3CCCCC3)cc2)C(=O)OCC)cc1

nearest known ligand 0.63

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
MMP13 P45452 10/20 0.63
MMP1 P03956 9/20 0.63
MMP9 P14780 9/20 0.63
KDM4E B2RXH2 1/20 0.46
HRH3 Q9Y5N1 4/20 0.44
KCNH2 Q12809 3/20 0.44
ADAM17 P78536 4/20 0.43
MMP2 P08253 1/20 0.43
MMP14 P50281 1/20 0.43
PSMB1 P20618 1/20 0.43
PSMB5 P28074 1/20 0.43
PSMB2 P49721 1/20 0.43

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
SCHEMBL6933401 0.90 MMP1 (0.77) MMP13MMP1MMP9KDM4EHRH3
SCHEMBL6658476 0.89 MMP1 (0.65) MMP13MMP1MMP9KDM4EHRH3
SCHEMBL6929947 0.89 MMP1 (0.75) MMP13MMP1MMP9KDM4EHRH3
SCHEMBL6931985 0.89 MMP1 (0.70) MMP13MMP1MMP9KDM4EHRH3
SCHEMBL5157944 0.89 MMP1 (0.75) MMP13MMP1MMP9KDM4EHRH3
SCHEMBL6657950 0.87 MMP13 (0.80) MMP13MMP1MMP9ADAM17MMP2
SCHEMBL6657386 0.81 MMP13 (0.53) MMP13MMP1MMP9ADAM17MMP2
SCHEMBL6929879 0.81 MMP1 (0.56) MMP13MMP1MMP9KDM4EHRH3
SCHEMBL6929395 0.80 MMP1 (0.62) MMP13MMP1MMP9KDM4EADAM17
SCHEMBL7132643 0.80 MMP1 (0.77) MMP13MMP1MMP9KDM4EHRH3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6825354-B2 OSTEOPOROSIS; RHEUMATIC DISEASES WYETH HOLDINGS CORPORATION 2004-11-30 US disclosed
EP-1147080-B1 ALKYNYL CONTAINING HYDROXAMIC ACID COMPOUNDS AS TACE INHIBITORS WYETH CORP (US) 2004-07-21 EP disclosed
US-20020147342-A1 Alkynyl containing hydroxamic acid compounds as matrix metalloproteinase and tace inhibitors AMERICAN CYANAMID COMPANY (US) 2002-10-10 US disclosed
US-6340691-B1 TREATMENT OF ARTHRITIS, TUMOR METASTASIS, TISSUE ULCERATION, ABNORMAL WOUND HEALING, PERIODONTAL DISEASE, BONE DISEASE, DIABETES (INSULIN RESISTANCE) AND HIV INFECTION AMERICAN CYANAMID COMPANY 2002-01-22 US disclosed
EP-1147080-A1 ALKYNYL CONTAINING HYDROXAMIC ACID COMPOUNDS AS TACE INHIBITORS American Cyanamid Company (US) 2001-10-24 EP disclosed
WO-2000044713-A1 ALKYNYL CONTAINING HYDROXAMIC ACID COMPOUNDS AS TACE INHIBITORS AMERICAN CYANAMID COMPANY (US) 2000-08-03 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-20020147342-A1 Alkynyl containing hydroxamic acid compounds as matrix metalloproteinase and tace inhibitors MMP12, MMP17, MMP14 MMP13 12/4885MMP1 17/4885MMP9 14/4885

“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.