SCHEMBL3379304

SCHEMBL3379304

Cc1noc(-c2cc3cc(-c4ccnc(C(=O)O)c4)ccc3[nH]2)n1

nearest known ligand 0.70

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
MMP13 P45452 1/20 0.52

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
SCHEMBL3376994 0.85
SCHEMBL1316251 0.83 MMP13 (0.60) MMP13
SCHEMBL15875947 0.82 S1PR1 (0.43)
SCHEMBL1314812 0.82 MMP13 (0.73) MMP13
SCHEMBL1313714 0.81
SCHEMBL3375112 0.79 MMP13 (0.51) MMP13
SCHEMBL3378229 0.79 MMP13 (0.68) MMP13
SCHEMBL3378348 0.78 KMO (0.48) MMP13
SCHEMBL3372699 0.78 MMP13 (0.56) MMP13
SCHEMBL1314443 0.74 MMP13 (0.67) MMP13

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 3 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
WO-2010045188-A1 HETEROARYL SUBSTITUTED INDOLE COMPOUNDS USEFUL AS MMP-13 INHIBITORS BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2010-04-22 WO disclosed