SCHEMBL4010318

SCHEMBL4010318

CC(C)[C@H](NS(=O)(=O)c1ccc2oc3cc(N)ccc3c2c1)C(=O)O

nearest known ligand 0.89

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
MMP12 P39900 20/20 0.89
MMP13 P45452 14/20 0.89
MMP2 P08253 1/20 0.67
MMP3 P08254 1/20 0.67
MMP9 P14780 1/20 0.67
MMP14 P50281 1/20 0.67

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
SCHEMBL4014961 1.00 MMP12 (0.89) MMP12MMP13MMP2MMP3MMP9
SCHEMBL3098324 1.00 MMP12 (0.89) MMP12MMP13MMP2MMP3MMP9
SCHEMBL4013291 0.96 MMP12 (0.89) MMP12MMP13MMP2MMP3MMP9
SCHEMBL3085334 0.96 MMP12 (0.89) MMP12MMP13MMP2MMP3MMP9
SCHEMBL3073194 0.94 MMP12 (1.00) MMP12MMP13MMP2MMP3MMP9
SCHEMBL4009639 0.94 MMP12 (1.00) MMP12MMP13MMP2MMP3MMP9
SCHEMBL3088682 0.89 MMP12 (0.71) MMP12MMP13MMP2MMP3MMP9
SCHEMBL3088680 0.89 MMP12 (0.71) MMP12MMP13MMP2MMP3MMP9
SCHEMBL6339020 0.87 MMP12 (0.76) MMP12MMP13MMP2MMP3MMP9
SCHEMBL3079186 0.87 MMP12 (0.76) 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 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