SCHEMBL14501347

SCHEMBL14501347

COc1ccc(S(=O)(=O)N2C[C@H](O)[C@H]3OC(C)(C)O[C@H]3[C@@H]2C(=O)NOCc2ccccc2)cc1

nearest known ligand 0.71

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
MMP3 P08254 20/20 0.71
MMP9 P14780 20/20 0.71
MMP1 P03956 16/20 0.71
ADAM17 P78536 13/20 0.71
MMP13 P45452 7/20 0.53
MMP2 P08253 4/20 0.53
MMP7 P09237 3/20 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
SCHEMBL5335517 1.00 MMP3 (0.71) MMP3MMP9MMP1ADAM17MMP13
SCHEMBL5343875 1.00 MMP3 (0.71) MMP3MMP9MMP1ADAM17MMP13
SCHEMBL5339997 1.00 MMP3 (0.71) MMP3MMP9MMP1ADAM17MMP13
SCHEMBL5340407 1.00 MMP3 (0.71) MMP3MMP9MMP1ADAM17MMP13
SCHEMBL5342076 0.93 MMP3 (0.61) MMP3MMP9MMP1ADAM17MMP13
SCHEMBL5341314 0.89 MMP3 (0.72) MMP3MMP9MMP1ADAM17MMP13
SCHEMBL5345933 0.89 MMP3 (0.72) MMP3MMP9MMP1ADAM17MMP13
SCHEMBL5344251 0.89 MMP9 (0.56) MMP3MMP9MMP1ADAM17MMP13
SCHEMBL5345757 0.87 MMP3 (0.67) MMP3MMP9MMP1ADAM17MMP13
SCHEMBL5343277 0.86 MMP9 (0.53) MMP3MMP9MMP1ADAM17MMP13

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
US-7223779-B2 Azasugar derivative and drug containing the same as the active ingredient CARNA BIOSCIENCES INC. (JP) 2007-05-29 US disclosed