SCHEMBL7921057

SCHEMBL7921057

CCOC(=O)c1cc2cc(-c3cc(C(=O)NCc4ccc(C(=O)OC)cc4)nn3C)ccc2[nH]1

nearest known ligand 0.88

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
MMP13 P45452 7/20 0.88
MMP14 P50281 3/20 0.88
MMP2 P08253 2/20 0.88
DRD5 P21918 2/20 0.88
AURKA O14965 1/20 0.88
MMP10 P09238 1/20 0.88
MMP9 P14780 1/20 0.88
PRKACA P17612 1/20 0.88
MAPKAPK2 P49137 1/20 0.88
PRKAA1 Q13131 1/20 0.88

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
Bi 4394 SCHEMBL1314835 0.93 MMP13 (1.00) MMP13MMP14MMP2DRD5AURKA
SCHEMBL1313430 0.91 MMP13 (0.86) MMP13MMP14MMP2DRD5AURKA
SCHEMBL7918685 0.91 MMP13 (0.86) MMP13MMP14MMP2DRD5AURKA
SCHEMBL1313126 0.90 MMP13 (1.00) MMP13MMP14MMP2DRD5AURKA
SCHEMBL1313866 0.90 MMP13 (1.00) MMP13MMP14MMP2DRD5AURKA
SCHEMBL1314185 0.87 MMP13 (1.00) MMP13MMP14MMP2DRD5AURKA
SCHEMBL1313634 0.83 MMP13 (1.00) MMP13MMP14MMP2DRD5AURKA
SCHEMBL1314304 0.79 MMP13 (1.00) MMP13MMP14MMP2DRD5AURKA
SCHEMBL1316395 0.78 MMP13 (0.73) MMP13MMP14MMP2DRD5AURKA
SCHEMBL12122314 0.77 MMP13 (0.81) MMP13MMP14MMP2DRD5AURKA

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-2340243-B1 HETEROARYL SUBSTITUTED INDOLE COMPOUNDS USEFUL AS MMP-13 INHIBITORS BOEHRINGER INGELHEIM INT (DE) 2014-10-08 EP disclosed
US-8785489-B2 Heteroaryl substituted indole compounds useful as MMP-13 inhibitors BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2014-07-22 US disclosed
US-20110275631-A1 Heteroaryl Substituted Indole Compounds Useful as MMP-13 Inhibitors BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2011-11-10 US disclosed
WO-2010045188-A1 HETEROARYL SUBSTITUTED INDOLE COMPOUNDS USEFUL AS MMP-13 INHIBITORS BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2010-04-22 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-20110275631-A1 Heteroaryl Substituted Indole Compounds Useful as MMP-13 Inhibitors MMP13, MMP3, MMP11 MMP13 1/4885MMP14 9/4885MMP2 5/4885

“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.