SCHEMBL3071879

SCHEMBL3071879

COC(=O)[C@H](NS(=O)(=O)c1ccc2oc3cc(I)ccc3c2c1)C(C)C

nearest known ligand 0.62

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
MMP12 P39900 20/20 0.62
MMP13 P45452 17/20 0.62
MMP2 P08253 1/20 0.59
MMP3 P08254 1/20 0.59
MMP9 P14780 1/20 0.59
MMP14 P50281 1/20 0.59

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
SCHEMBL3071876 1.00 MMP12 (0.62) MMP12MMP13MMP2MMP3MMP9
SCHEMBL3079296 0.95 MMP12 (0.60) MMP12MMP13MMP2MMP3MMP9
SCHEMBL3079301 0.95 MMP12 (0.60) MMP12MMP13MMP2MMP3MMP9
SCHEMBL3079186 0.89 MMP12 (0.76) MMP12MMP13MMP2MMP3MMP9
SCHEMBL3088682 0.87 MMP12 (0.71) MMP12MMP13MMP2MMP3MMP9
SCHEMBL3088680 0.87 MMP12 (0.71) MMP12MMP13MMP2MMP3MMP9
SCHEMBL3081333 0.86 MMP12 (0.61) MMP12MMP13MMP2MMP3MMP9
SCHEMBL3081334 0.86 MMP12 (0.61) MMP12MMP13MMP2MMP3MMP9
SCHEMBL4009453 0.85 MMP12 (0.71) MMP12MMP13MMP2MMP3MMP9
SCHEMBL3076225 0.85 MMP12 (0.62) MMP12MMP13MMP2MMP3MMP9

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 7 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 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
EP-2144893-A2 TRICYCLIC COMPOUNDS AS MATRIX METALLOPROTEINASE INHIBITORS Wyeth a Corporation of the State of Delaware (US) 2010-01-20 EP disclosed
EP-2074107-A2 TRICYCLIC COMPOUNDS AS MATRIX METALLOPROTEINASE INHIBITORS Wyeth a Corporation of the State of Delaware (US) 2009-07-01 EP disclosed
WO-2008137816-A2 TRICYCLIC COMPOUNDS AS MATRIX METALLOPROTEINASE INHIBITORS WYETH (US) 2008-11-13 WO disclosed
WO-2008057254-A2 TRICYCLIC COMPOUNDS AS MATRIX METALLOPROTEINASE INHIBITORS WYETH (US) 2008-05-15 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-20100227859-A1 TRICYCLIC COMPOUNDS AS MATRIX METALLOPROTEINASE INHIBITORS MMP13, MMP2, MMP12 MMP12 3/4885MMP13 1/4885MMP2 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.