SCHEMBL7420895

SCHEMBL7420895

CCSC(c1ccccc1)C(NS(=O)(=O)c1ccc(-c2ccc(F)cc2)cc1)C(=O)O

nearest known ligand 0.61

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
MMP2 P08253 9/20 0.61
MMP13 P45452 8/20 0.61
MMP3 P08254 6/20 0.61
MMP9 P14780 6/20 0.61
MMP1 P03956 5/20 0.61
MMP7 P09237 4/20 0.61
ADAMTS4 O75173 8/20 0.54
SLC1A3 P43003 2/20 0.51
SLC1A2 P43004 2/20 0.51
SLC1A1 P43005 2/20 0.51
MMP14 P50281 2/20 0.48
MMP8 P22894 1/20 0.47
MMP12 P39900 1/20 0.47

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
SCHEMBL6732102 1.00 MMP2 (0.61) MMP2MMP13MMP3MMP9MMP1
SCHEMBL7384080 0.90 MMP2 (0.52) MMP2MMP13MMP3MMP9MMP1
SCHEMBL6732931 0.90 MMP2 (0.52) MMP2MMP13MMP3MMP9MMP1
SCHEMBL6738197 0.87 MMP13 (0.63) MMP2MMP13MMP3MMP9MMP1
SCHEMBL6732456 0.87 MMP13 (0.63) MMP2MMP13MMP3MMP9MMP1
SCHEMBL6739709 0.83 ADAMTS4 (0.56) MMP2MMP13MMP3MMP9MMP1
SCHEMBL6737769 0.81 MMP2 (0.57) MMP2MMP13MMP3MMP9MMP1
SCHEMBL6732449 0.80 MMP2 (0.56) MMP2MMP13MMP3MMP9MMP1
SCHEMBL6742257 0.79 MMP13 (0.58) MMP2MMP13MMP3MMP9MMP1
SCHEMBL7380366 0.78 MMP13 (0.52) MMP2MMP13MMP3MMP9MMP1

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-1224171-A1 BETA DISUBSTITUTED METALLOPROTEASE INHIBITORS THE PROCTER & GAMBLE COMPANY (US) 2002-07-24 EP disclosed
WO-2001027084-A1 BETA DISUBSTITUTED METALLOPROTEASE INHIBITORS THE PROCTER & GAMBLE COMPANY (US) 2001-04-19 WO disclosed