SCHEMBL6660841

SCHEMBL6660841

CC#CCOc1ccc(SOC(=O)Cc2cccc(Cl)c2)cc1

nearest known ligand 0.43

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
MAOB P27338 5/20 0.43
MAOA P21397 3/20 0.43
ALOX5 P09917 1/20 0.42
ADAM17 P78536 5/20 0.41
RXRA P19793 1/20 0.41
RXRB P28702 1/20 0.41
RXRG P48443 1/20 0.41
GAA P10253 1/20 0.39
ALOX12 P18054 1/20 0.39
MMP9 P14780 2/20 0.37
MMP13 P45452 2/20 0.37
KMT2A Q03164 1/20 0.37

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
SCHEMBL6654871 0.87 ADAM17 (0.43) MAOBMAOAADAM17MMP9MMP13
SCHEMBL6662479 0.86 ADAM17 (0.44) MAOBMAOAADAM17MMP9MMP13
SCHEMBL6655286 0.86 ADAM17 (0.51) ALOX5ADAM17MMP9MMP13
SCHEMBL6656661 0.83 ADAM17 (0.44) ADAM17MMP9MMP13KMT2A
SCHEMBL6656959 0.81 ADAM17 (0.52) ADAM17GAAMMP9MMP13KMT2A
SCHEMBL6656714 0.81 ADAM17 (0.45) ADAM17MMP9MMP13
SCHEMBL6658036 0.77 PSMB5 (0.39) ADAM17MMP9MMP13
SCHEMBL6656469 0.74 ADAM17 (0.56) ADAM17MMP9MMP13
SCHEMBL6787626 0.73 ALOX5 (0.49) MAOBMAOAALOX5ADAM17RXRA
SCHEMBL6656399 0.72 ADAM17 (0.62) ALOX5ADAM17MMP9MMP13KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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
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 MAOB 1673/4885MAOA 1356/4885ALOX5 500/4885

“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.