SCHEMBL5492391

SCHEMBL5492391

CC1(CS(=O)(=O)N2CCc3cc(-c4cnc(C5CC5)nc4)ccc3C2)NC(=O)NC1=O

nearest known ligand 0.44

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
MMP13 P45452 20/20 0.44
MMP14 P50281 9/20 0.44
MMP12 P39900 5/20 0.44

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
SCHEMBL587505 1.00 MMP13 (0.44) MMP13MMP14MMP12
SCHEMBL587427 0.97 MMP13 (0.43) MMP13MMP14MMP12
SCHEMBL3109399 0.96 MMP13 (0.42) MMP13MMP14MMP12
SCHEMBL588084 0.88 MMP13 (0.34) MMP13MMP14MMP12
SCHEMBL585311 0.88 MMP13 (0.34) MMP13MMP14MMP12
SCHEMBL5492410 0.88 MMP13 (0.42) MMP13MMP14MMP12
SCHEMBL587491 0.88 ADAMTS5 (0.35) MMP13MMP14MMP12
SCHEMBL587143 0.88 MMP13 (0.42) MMP13MMP14MMP12
SCHEMBL587210 0.88 MMP13 (0.41) MMP13MMP14MMP12
SCHEMBL5318545 0.86 MMP13 (0.45) MMP13MMP14MMP12

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-1831199-A1 NOVEL COMPOUNDS AstraZeneca AB (SE) 2007-09-12 EP claimed
WO-2006065215-A1 NOVEL COMPOUNDS ASTRAZENECA AB (SE) 2006-06-22 WO claimed