SCHEMBL16389082

SCHEMBL16389082

CNC(=O)C(NC(=O)c1ccc(-c2ccc(-c3ccccc3)cn2)o1)C1CCCCC1

nearest known ligand 0.75

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ MMP13 P45452 20/20 0.75
▸ MMP2 P08253 1/20 0.62

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
SCHEMBL7912585 1.00 MMP13 (0.75) MMP13MMP2
SCHEMBL16389081 0.92 MMP13 (0.74) MMP13MMP2
SCHEMBL1316545 0.92 MMP13 (0.74) MMP13MMP2
SCHEMBL12120765 0.89 MMP13 (0.70) MMP13MMP2
SCHEMBL1318706 0.87 MMP13 (0.80) MMP13MMP2
SCHEMBL1315900 0.86 MMP13 (0.79) MMP13MMP2
SCHEMBL1319146 0.86 MMP13 (1.00) MMP13MMP2
SCHEMBL12123421 0.86 MMP13 (0.79) MMP13MMP2
SCHEMBL1315796 0.85 MMP13 (0.81) MMP13MMP2
SCHEMBL1317274 0.84 MMP13 (0.73) MMP13MMP2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2346831-B1 HETEROARYL DIAMIDE COMPOUNDS USEFUL AS MMP-13 INHIBITORS BOEHRINGER INGELHEIM INT (DE) 2015-01-07 — — EP disclosed
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