SCHEMBL4008618

SCHEMBL4008618

CC(C)[C@H](NS(=O)(=O)c1ccc2c(c1)sc1cc(NC(=O)NCCc3cccs3)ccc12)C(=O)O

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
MMP12 P39900 20/20 1.00
MMP13 P45452 17/20 1.00

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
SCHEMBL31490328 1.00 MMP12 (1.00) MMP12MMP13
SCHEMBL31490343 0.89 MMP12 (0.83) MMP12MMP13
SCHEMBL4011224 0.89 MMP12 (0.83) MMP12MMP13
SCHEMBL31490236 0.88 MMP12 (1.00) MMP12MMP13
SCHEMBL4010948 0.88 MMP12 (1.00) MMP12MMP13
SCHEMBL4010193 0.86 MMP12 (0.94) MMP12MMP13
SCHEMBL31490335 0.86 MMP12 (1.00) MMP12MMP13
SCHEMBL4011581 0.86 MMP12 (1.00) MMP12MMP13
SCHEMBL4016505 0.85 MMP12 (1.00) MMP12MMP13
SCHEMBL4011972 0.83 MMP12 (1.00) 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 4 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