SCHEMBL7600749

SCHEMBL7600749

CN1C(=O)OC[C@H]1C(O)(CS(=O)(=O)c1ccc(Oc2ccc(OC(F)(F)F)cc2)cc1)C(N)=O

nearest known ligand 0.43

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
MMP9 P14780 18/20 0.43
MMP2 P08253 12/20 0.43
MMP14 P50281 6/20 0.43
MMP3 P08254 4/20 0.41
MMP13 P45452 3/20 0.41
MMP1 P03956 7/20 0.39
MMP8 P22894 4/20 0.39
MMP7 P09237 2/20 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
SCHEMBL7603274 0.79 MMP9 (0.47) MMP9MMP2MMP14MMP3MMP13
SCHEMBL7599808 0.79 MMP9 (0.55) MMP9MMP2MMP14MMP3MMP13
SCHEMBL7600044 0.75 MMP9 (0.52) MMP9MMP2MMP14MMP3MMP13
SCHEMBL7599651 0.75 MMP9 (0.52) MMP9MMP2MMP14MMP3MMP13
SCHEMBL7583731 0.74 MMP9 (0.45) MMP9MMP2MMP14MMP3MMP13
SCHEMBL7583727 0.70 MMP9 (0.65) MMP9MMP2MMP3MMP13MMP1
SCHEMBL7583739 0.70 MMP9 (0.65) MMP9MMP2MMP3MMP13MMP1
SCHEMBL8005756 0.65 MMP2 (0.50) MMP9MMP2MMP14MMP3MMP13
SCHEMBL7679710 0.64 MMP9 (0.58) MMP9MMP2MMP14MMP3MMP13
SCHEMBL7365907 0.63 MMP2 (0.48) MMP9MMP2MMP14MMP3MMP13

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
EP-1147101-B1 REVERSE HYDROXAMATE INHIBITORS OF MATRIX METALLOPROTEINASES ABBOTT LAB (US) 2002-11-20 EP claimed