SCHEMBL5263429

SCHEMBL5263429

COc1cccc(CCNC(=O)c2nc3ccc(O)cc3c(=O)[nH]2)c1

nearest known ligand 0.66

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
MMP13 P45452 20/20 0.66

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
SCHEMBL4930401 0.90 MMP13 (0.79) MMP13
SCHEMBL4934626 0.89 MMP13 (0.71) MMP13
SCHEMBL4934683 0.83 MMP13 (0.87) MMP13
SCHEMBL4933502 0.80 MMP13 (0.79) MMP13
SCHEMBL4930771 0.80 MMP13 (0.79) MMP13
SCHEMBL3641284 0.80 MMP13 (0.86) MMP13
SCHEMBL5264073 0.80 MMP13 (0.66) MMP13
SCHEMBL4930565 0.80 MMP13 (0.78) MMP13
SCHEMBL4933798 0.80 MMP13 (0.78) MMP13
SCHEMBL4936934 0.80 MMP13 (0.78) 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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1740551-A1 HETEROCYCLIC AMIDE COMPOUND AND USE THEREOF AS AN MMP-13 INHIBITOR Takeda Pharmaceutical Company Limited (JP) 2007-01-10 EP disclosed
WO-2005105760-A1 HETEROCYCLIC AMIDE COMPOUND AND USE THEREOF AS AN MMP-13 INHIBITOR TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2005-11-10 WO disclosed