SCHEMBL6657563

SCHEMBL6657563

CC#CCOc1ccc(OCCC(=O)O)cc1

nearest known ligand 0.62

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 2/20 0.62
MMP2 P08253 3/20 0.54
ADAM17 P78536 13/20 0.48
MMP1 P03956 8/20 0.48
MMP9 P14780 8/20 0.48
MMP13 P45452 8/20 0.48
LMNA P02545 1/20 0.47
MMP14 P50281 1/20 0.47
FFAR1 O14842 1/20 0.45
MCL1 Q07820 1/20 0.45
MMP7 P09237 1/20 0.45
MMP8 P22894 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
SCHEMBL6661623 0.92 L3MBTL1 (0.51) L3MBTL1MMP2ADAM17MMP1MMP9
SCHEMBL6661575 0.83 ALOX15 (0.55) MMP2ADAM17MMP1MMP9MMP13
SCHEMBL3940404 0.83 ADAM17 (0.64) MMP2ADAM17MMP1MMP9MMP13
SCHEMBL6659297 0.81 FFAR1 (0.55) L3MBTL1MMP2ADAM17MMP9MMP13
SCHEMBL15274643 0.80 ADAM17 (0.58) MMP2ADAM17MMP1MMP9MMP13
SCHEMBL1503527 0.79 PKM (0.53) MMP2ADAM17MMP1MMP9MMP13
SCHEMBL6701805 0.79 MMP1 (0.60) MMP2ADAM17MMP1MMP9MMP13
SCHEMBL3947498 0.78 MMP1 (0.63) MMP2ADAM17MMP1MMP9MMP13
SCHEMBL23425517 0.77 ADAM17 (0.50) MMP2ADAM17MMP1MMP9MMP13
SCHEMBL6657063 0.77 FAAH (0.52)

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 L3MBTL1 2834/4885MMP2 22/4885ADAM17 7/4885

“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.