SCHEMBL7434872

SCHEMBL7434872

Cc1ccc(Oc2ccc(S(=O)(=O)C(CN(O)C=O)[C@@H]3COC(C)(C)O3)cc2)cc1

nearest known ligand 0.52

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
MMP9 P14780 17/20 0.52
MMP2 P08253 14/20 0.52
MMP1 P03956 9/20 0.52
MMP13 P45452 2/20 0.52
MMP3 P08254 1/20 0.52
MMP7 P09237 1/20 0.52
MMP8 P22894 1/20 0.52
HTT P42858 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
FPR2 P25090 1/20 0.32
SCN9A Q15858 1/20 0.32

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
SCHEMBL7421799 0.92 MMP9 (0.52) MMP9MMP2MMP1MMP13MMP3
SCHEMBL7430869 0.88 MMP2 (0.49) MMP9MMP2MMP1MMP13MMP3
SCHEMBL7434867 0.80 MMP9 (0.43) MMP9MMP2MMP1MMP13MMP3
SCHEMBL7596470 0.79 MMP9 (0.80) MMP9MMP2MMP1MMP13MMP3
SCHEMBL7596477 0.79 MMP9 (0.80) MMP9MMP2MMP1MMP13MMP3
SCHEMBL7421796 0.74 MMP1 (0.43) MMP9MMP2MMP1MMP13MMP3
SCHEMBL4429590 0.72 MMP9 (0.37) MMP9MMP2MMP1MMP13MMP3
SCHEMBL7595943 0.71 MMP9 (0.80) MMP9MMP2MMP1MMP13MMP3
SCHEMBL7595948 0.71 MMP9 (0.80) MMP9MMP2MMP1MMP13MMP3
SCHEMBL7597601 0.71 MMP9 (0.80) MMP9MMP2MMP1MMP13MMP3

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-1147101-A1 REVERSE HYDROXAMATE INHIBITORS OF MATRIX METALLOPROTEINASES ABBOTT LABORATORIES (US) 2001-10-24 EP claimed
WO-2000044739-A1 REVERSE HYDROXAMATE INHIBITORS OF MATRIX METALLOPROTEINASES ABBOTT LABORATORIES (US) 2000-08-03 WO claimed