SCHEMBL5318545

SCHEMBL5318545

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

nearest known ligand 0.45

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
MMP13 P45452 20/20 0.45
MMP14 P50281 10/20 0.45
MMP12 P39900 4/20 0.45
KCNH2 Q12809 2/20 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
SCHEMBL3338479 1.00 MMP13 (0.45) MMP13MMP14MMP12KCNH2
SCHEMBL587210 0.88 MMP13 (0.41) MMP13MMP14MMP12
SCHEMBL5492391 0.86 MMP13 (0.44) MMP13MMP14MMP12
SCHEMBL587505 0.86 MMP13 (0.44) MMP13MMP14MMP12
SCHEMBL587427 0.84 MMP13 (0.43) MMP13MMP14MMP12
SCHEMBL3109399 0.82 MMP13 (0.42) MMP13MMP14MMP12
SCHEMBL3339306 0.82 MMP13 (0.54) MMP13MMP14MMP12KCNH2
SCHEMBL3337202 0.82 CYP11B1 (0.50) MMP13MMP14
SCHEMBL3338616 0.80 MMP13 (0.45) MMP13MMP14MMP12KCNH2
SCHEMBL3337043 0.79 MMP13 (0.44) 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-1831196-A1 NOVEL HYDANTOIN DERIVATIVES AS METALLOPROTEINASE INHIBITORS AstraZeneca AB (SE) 2007-09-12 EP claimed
WO-2006065216-A1 NOVEL HYDANTOIN DERIVATIVES AS METALLOPROTEINASE INHIBITORS ASTRAZENECA AB (SE) 2006-06-22 WO claimed