SCHEMBL6157798

SCHEMBL6157798

CC(C)C(CC(=O)NOCc1ccccc1)C(=O)NC(CC(=O)OCc1ccccc1)C(=O)CBr

nearest known ligand 0.47

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
MMP9 P14780 2/20 0.47
SLC15A1 P46059 2/20 0.47
CA12 O43570 1/20 0.46
MMP1 P03956 4/20 0.43
CASP1 P29466 6/20 0.43
CA4 P22748 1/20 0.40
MMP2 P08253 1/20 0.40
MMP8 P22894 1/20 0.40

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
SCHEMBL6158897 0.84 MMP9 (0.45) MMP9SLC15A1CA12MMP1CASP1
SCHEMBL7428604 0.84 MMP9 (0.45) MMP9SLC15A1CA12MMP1CASP1
SCHEMBL7397045 0.79 ECE1 (0.60) MMP9MMP1CASP1MMP2MMP8
SCHEMBL27561841 0.77 SLC15A1 (0.46) MMP9SLC15A1CA12MMP1CASP1
SCHEMBL7395723 0.75 NPC1 (0.50) MMP9SLC15A1MMP2MMP8
SCHEMBL6159923 0.75 USP2 (0.39) MMP9CA12MMP1CASP1MMP2
SCHEMBL20827013 0.73 CASP1 (0.55) CASP1
SCHEMBL6160245 0.73 MMP9 (0.47) MMP9SLC15A1CA12MMP1
SCHEMBL7402537 0.72 ECE1 (0.56) CA12CASP1CA4
SCHEMBL27544008 0.72 CASP3 (0.59) CASP1

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-1082127-B1 SUCCINAMIDE INHIBITORS OF INTERLEUKIN-1BETA CONVERTING ENZYME WARNER LAMBERT CO (US) 2005-06-22 EP disclosed
EP-1082127-A4 SUCCINAMIDE INHIBITORS OF INTERLEUKIN-1$g(b) CONVERTING ENZYME WARNER LAMBERT CO (US) 2002-10-09 EP disclosed
CN-1308542-A Succinamide inhibitors of interleukin-1 beta converting enzyme WARNET LAMBERT CO (US) 2001-08-15 CN disclosed
EP-1082127-A1 SUCCINAMIDE INHIBITORS OF INTERLEUKIN-1$g(b) CONVERTING ENZYME WARNER-LAMBERT COMPANY (US) 2001-03-14 EP disclosed
WO-1999056765-A1 SUCCINAMIDE INHIBITORS OF INTERLEUKIN-1β CONVERTING ENZYME WARNER-LAMBERT COMPANY (US) 1999-11-11 WO disclosed