SCHEMBL4013072

SCHEMBL4013072

COC(=O)Nc1ccc2c(sc3cc(S(=O)(=O)N[C@H](C(=O)O)C(C)C)ccc32)c1Cl

nearest known ligand 0.69

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
MMP12 P39900 20/20 0.69
MMP13 P45452 16/20 0.69

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
SCHEMBL31490142 1.00 MMP12 (0.69) MMP12MMP13
SCHEMBL4014786 0.82 MMP12 (1.00) MMP12MMP13
SCHEMBL4010703 0.82 MMP12 (1.00) MMP12MMP13
SCHEMBL4012762 0.82 MMP12 (1.00) MMP12MMP13
SCHEMBL31490292 0.82 MMP12 (1.00) MMP12MMP13
SCHEMBL4011054 0.82 MMP12 (1.00) MMP12MMP13
SCHEMBL31490091 0.82 MMP12 (1.00) MMP12MMP13
SCHEMBL4013634 0.78 MMP12 (1.00) MMP12MMP13
SCHEMBL4010355 0.78 MMP12 (1.00) MMP12MMP13
SCHEMBL8087830 0.77 MMP12 (0.69) MMP12MMP13

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2074107-A2 TRICYCLIC COMPOUNDS AS MATRIX METALLOPROTEINASE INHIBITORS Wyeth a Corporation of the State of Delaware (US) 2009-07-01 EP claimed
WO-2008057254-A2 TRICYCLIC COMPOUNDS AS MATRIX METALLOPROTEINASE INHIBITORS WYETH (US) 2008-05-15 WO claimed
EP-2074107-A2 TRICYCLIC COMPOUNDS AS MATRIX METALLOPROTEINASE INHIBITORS Wyeth a Corporation of the State of Delaware (US) 2009-07-01 EP disclosed
WO-2008057254-A2 TRICYCLIC COMPOUNDS AS MATRIX METALLOPROTEINASE INHIBITORS WYETH (US) 2008-05-15 WO disclosed
WO-2008057254-A2 TRICYCLIC COMPOUNDS AS MATRIX METALLOPROTEINASE INHIBITORS WYETH (US) 2008-05-15 WO disclosed