SCHEMBL7430869

SCHEMBL7430869

COCCOc1ccc(Oc2ccc(S(=O)(=O)C(CN(O)C=O)[C@@H]3COC(C)(C)O3)cc2)cc1

nearest known ligand 0.49

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
MMP2 P08253 18/20 0.49
MMP9 P14780 17/20 0.49
MMP1 P03956 11/20 0.49
MMP3 P08254 3/20 0.49
MMP13 P45452 3/20 0.49
MMP7 P09237 2/20 0.49
MMP8 P22894 1/20 0.49

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 0.90 MMP9 (0.52) MMP2MMP9MMP1MMP3MMP13
SCHEMBL7434872 0.88 MMP9 (0.52) MMP2MMP9MMP1MMP3MMP13
SCHEMBL7426328 0.81 MMP2 (0.40) MMP2MMP9MMP1MMP3MMP13
SCHEMBL7595400 0.81 MMP9 (0.74) MMP2MMP9MMP1MMP3MMP13
SCHEMBL7595412 0.81 MMP9 (0.74) MMP2MMP9MMP1MMP3MMP13
SCHEMBL7483524 0.75 MMP9 (0.66) MMP2MMP9MMP1MMP3MMP13
SCHEMBL7595406 0.73 MMP9 (0.47) MMP2MMP9MMP1MMP3MMP13
SCHEMBL7421796 0.70 MMP1 (0.43) MMP2MMP9MMP1MMP3MMP13
SCHEMBL7595948 0.70 MMP9 (0.80) MMP2MMP9MMP1MMP3MMP13
SCHEMBL7595943 0.70 MMP9 (0.80) MMP2MMP9MMP1MMP3MMP13

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