SCHEMBL6865083

SCHEMBL6865083

CN(CCN(CC(=O)NO)S(=O)(=O)c1cc(F)c(Oc2ccc(Cl)cc2)c(F)c1)CC(=O)O

nearest known ligand 0.48

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
MMP1 P03956 5/20 0.48
MMP8 P22894 3/20 0.48
MMP13 P45452 3/20 0.48
MMP2 P08253 2/20 0.48
MMP9 P14780 2/20 0.48
MMP14 P50281 1/20 0.48
MMP16 P51512 1/20 0.48
MEP1B Q16820 3/20 0.48
MMP7 P09237 2/20 0.44
MMP12 P39900 2/20 0.44
BMP1 P13497 3/20 0.42
DAGLA Q9Y4D2 3/20 0.42
MMP3 P08254 5/20 0.41
CA2 P00918 1/20 0.39
CA9 Q16790 1/20 0.39

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
SCHEMBL328390 0.92 MMP1 (0.43) MMP1MMP8MMP13MMP2MMP9
SCHEMBL328407 0.92 MMP1 (0.43) MMP1MMP8MMP13MMP2MMP9
SCHEMBL328552 0.89 MMP1 (0.45) MMP1MMP8MMP13MMP2MMP9
SCHEMBL6850664 0.89 DAGLA (0.43) MMP1MMP8MMP13MMP2MMP9
SCHEMBL6863112 0.88 MMP1 (0.42) MMP1MMP8MMP13MMP2MMP9
SCHEMBL328649 0.88 MMP1 (0.44) MMP1MMP8MMP13MMP2MMP9
SCHEMBL328398 0.87 MMP3 (0.45) MMP1MMP8MMP13MMP2MMP9
SCHEMBL6863163 0.87 MMP1 (0.44) MMP1MMP8MMP13MMP2MMP9
SCHEMBL6864397 0.87 MMP1 (0.44) MMP1MMP8MMP13MMP2MMP9
SCHEMBL328492 0.85 MMP1 (0.42) MMP1MMP8MMP13MMP2MMP9

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2011041545-A1 METHODS OF TREATING ANEURYSMAL DILATATION, BLOOD VESSEL WALL WEAKNESS AND SPECIFICALLY ABDOMINAL AORTIC AND THORACIC ANEURYSM USING MATRIX METALLOPROTEASE-2 INHIBITORS SYMPHONY EVOLUTION, INC. (US) 2011-04-07 WO disclosed