SCHEMBL7302387

SCHEMBL7302387

CC(C)(C)ONC(=O)CC(Cc1ccccc1)S(=O)(=O)c1ccc(-c2ccccc2)cc1

nearest known ligand 0.60

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
MMP2 P08253 13/20 0.60
MMP1 P03956 7/20 0.60
MMP3 P08254 6/20 0.60
PDE4A P27815 5/20 0.60
PDE4B Q07343 5/20 0.60
PDE4C Q08493 5/20 0.60
PDE4D Q08499 5/20 0.60
MMP9 P14780 6/20 0.45
ADAMTS4 O75173 1/20 0.45
MMP13 P45452 3/20 0.45
CA2 P00918 1/20 0.43
CA9 Q16790 1/20 0.43
ADAMTS5 Q9UNA0 1/20 0.41
ALDH1A1 P00352 1/20 0.41
MAPT P10636 1/20 0.41
MMP7 P09237 1/20 0.41

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
SCHEMBL7311602 0.93 MMP1 (0.62) MMP2MMP1MMP3PDE4APDE4B
SCHEMBL7305191 0.90 MMP1 (0.76) MMP2MMP1MMP3PDE4APDE4B
SCHEMBL7308348 0.90 MMP1 (0.62) MMP2MMP1MMP3PDE4APDE4B
SCHEMBL7308096 0.88 MMP1 (0.57) MMP2MMP1MMP3PDE4APDE4B
SCHEMBL7301051 0.86 MMP1 (0.57) MMP2MMP1MMP3PDE4APDE4B
SCHEMBL7308114 0.83 MMP2 (0.44) MMP2MMP1MMP3PDE4APDE4B
SCHEMBL7301418 0.82 PDE4A (0.61) MMP2MMP1MMP3PDE4APDE4B
SCHEMBL7302153 0.82 MMP2 (0.73) MMP2MMP1MMP3PDE4APDE4B
SCHEMBL7311001 0.81 PDE4A (0.56) MMP2MMP1MMP3PDE4APDE4B
SCHEMBL6823424 0.79 MMP1 (0.87) MMP2MMP1MMP3PDE4APDE4B

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-0780386-B1 Matrix metalloprotease inhibitors HOFFMANN LA ROCHE (CH) 2002-10-02 EP disclosed
EP-0780386-A1 Matrix metalloprotease inhibitors F. HOFFMANN-LA ROCHE AG (CH) 1997-06-25 EP disclosed