SCHEMBL3072246

SCHEMBL3072246

CC(C)(C)c1nc(-c2ccc3oc4cc(S(=O)(=O)N[C@H](C(=O)O)c5ccccc5)ccc4c3c2)no1

nearest known ligand 0.77

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
MMP12 P39900 20/20 0.77
MMP2 P08253 1/20 0.47
MMP3 P08254 1/20 0.47
MMP7 P09237 1/20 0.47
MMP9 P14780 1/20 0.47
MMP8 P22894 1/20 0.47
MMP13 P45452 1/20 0.47

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
SCHEMBL3085472 1.00 MMP12 (0.77) MMP12MMP2MMP3MMP7MMP9
SCHEMBL3091853 0.97 MMP12 (0.72) MMP12MMP13
SCHEMBL13144518 0.88 MMP12 (0.82) MMP12MMP2MMP3MMP7MMP9
SCHEMBL3079154 0.88 MMP12 (0.82) MMP12MMP2MMP3MMP7MMP9
SCHEMBL3090777 0.87 MMP12 (1.00) MMP12MMP2MMP3MMP7MMP9
SCHEMBL3089200 0.87 MMP12 (1.00) MMP12MMP2MMP3MMP7MMP9
SCHEMBL3072008 0.85 MMP12 (0.68) MMP12MMP2MMP9MMP13
SCHEMBL3079371 0.85 MMP12 (0.77) MMP12MMP2MMP3MMP7MMP9
SCHEMBL3079176 0.85 MMP12 (0.77) MMP12MMP2MMP3MMP7MMP9
SCHEMBL3117028 0.85 MMP12 (0.77) MMP12MMP2MMP3MMP7MMP9

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-20100227859-A1 TRICYCLIC COMPOUNDS AS MATRIX METALLOPROTEINASE INHIBITORS WYETH LLC 2010-09-09 US claimed
EP-2144893-A2 TRICYCLIC COMPOUNDS AS MATRIX METALLOPROTEINASE INHIBITORS Wyeth a Corporation of the State of Delaware (US) 2010-01-20 EP claimed
WO-2008137816-A2 TRICYCLIC COMPOUNDS AS MATRIX METALLOPROTEINASE INHIBITORS WYETH (US) 2008-11-13 WO claimed
US-20100227859-A1 TRICYCLIC COMPOUNDS AS MATRIX METALLOPROTEINASE INHIBITORS WYETH LLC 2010-09-09 US disclosed
US-20100227859-A1 TRICYCLIC COMPOUNDS AS MATRIX METALLOPROTEINASE INHIBITORS WYETH LLC 2010-09-09 US disclosed
US-20100227859-A1 TRICYCLIC COMPOUNDS AS MATRIX METALLOPROTEINASE INHIBITORS WYETH LLC 2010-09-09 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-20100227859-A1 TRICYCLIC COMPOUNDS AS MATRIX METALLOPROTEINASE INHIBITORS MMP13, MMP2, MMP12 MMP12 3/4885MMP2 2/4885MMP3 6/4885

“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.