SCHEMBL8200620

SCHEMBL8200620

CNS(=O)(=O)c1ccc2c(c1)oc1ccc(NC(=O)OC(C)C)cc12

nearest known ligand 0.69

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
MMP12 P39900 20/20 0.69
MMP13 P45452 18/20 0.69
MMP2 P08253 1/20 0.63
MMP3 P08254 1/20 0.63
MMP9 P14780 1/20 0.63
MMP14 P50281 1/20 0.63

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
SCHEMBL4010137 0.86 MMP12 (0.93) MMP12MMP13MMP2MMP3MMP9
SCHEMBL4012713 0.82 MMP12 (1.00) MMP12MMP13MMP2MMP3MMP9
SCHEMBL29988421 0.77 MMP12 (1.00) MMP12MMP13MMP2MMP3MMP9
SCHEMBL29518647 0.77 MMP12 (1.00) MMP12MMP13MMP2MMP3MMP9
SCHEMBL4009883 0.77 MMP12 (1.00) MMP12MMP13MMP2MMP3MMP9
SCHEMBL4011080 0.74 MMP12 (1.00) MMP12MMP13MMP2MMP3MMP9
SCHEMBL4008450 0.74 MMP12 (1.00) MMP12MMP13MMP2MMP3MMP9
SCHEMBL4017170 0.74 MMP12 (1.00) MMP12MMP13MMP2MMP3MMP9
SCHEMBL31490147 0.74 MMP12 (1.00) MMP12MMP13MMP2MMP3MMP9
SCHEMBL4012924 0.73 MMP12 (1.00) 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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2008057254-A2 TRICYCLIC COMPOUNDS AS MATRIX METALLOPROTEINASE INHIBITORS WYETH (US) 2008-05-15 WO disclosed