SCHEMBL7690202

SCHEMBL7690202

CC(C)(CS(=O)(=O)c1ccc(Oc2ccccc2)cc1)[C@@H](O)C(=O)NO

nearest known ligand 0.65

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
MMP13 P45452 19/20 0.65
MMP2 P08253 12/20 0.65
MMP1 P03956 10/20 0.65
MMP3 P08254 2/20 0.55
MMP9 P14780 2/20 0.55
MMP7 P09237 1/20 0.55
MMP8 P22894 1/20 0.52
MMP14 P50281 1/20 0.52
MMP16 P51512 1/20 0.52
ADAM17 P78536 1/20 0.52

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
SCHEMBL7683904 1.00 MMP13 (0.65) MMP13MMP2MMP1MMP3MMP9
SCHEMBL7690204 1.00 MMP13 (0.65) MMP13MMP2MMP1MMP3MMP9
Hydrochloric Acid SCHEMBL7688004 0.86 MMP13 (0.65) MMP13MMP2MMP1MMP3MMP9
Hydrochloric Acid SCHEMBL7688009 0.86 MMP13 (0.65) MMP13MMP2MMP1MMP3MMP9
SCHEMBL7683909 0.84 MMP13 (0.46) MMP13MMP2MMP1MMP3MMP9
SCHEMBL7683898 0.84 MMP13 (0.46) MMP13MMP2MMP1MMP3MMP9
SCHEMBL6769491 0.79 MMP13 (0.77) MMP13MMP2MMP1
SCHEMBL6767563 0.79 MMP13 (0.77) MMP13MMP2MMP1
SCHEMBL6767568 0.79 MMP13 (0.77) MMP13MMP2MMP1
SCHEMBL6764610 0.78 MMP13 (0.70) MMP13MMP2MMP1MMP3MMP9

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-6476027-B1 N-hydroxy 4-sulfonyl butanamide compounds MONSANTO COMPANY 2002-11-05 US disclosed