SCHEMBL5804205

SCHEMBL5804205

Cc1c(C(=O)Nc2ccc(-c3ccc(S(=O)(=O)N[C@H](C(=O)O)C(C)C)cc3)cc2)oc2cccc([C@@H](O)CO)c12

nearest known ligand 0.77

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
MMP2 P08253 20/20 0.77
MMP13 P45452 20/20 0.77
MMP14 P50281 3/20 0.71
MMP9 P14780 2/20 0.71
ADAMTS4 O75173 2/20 0.71
MMP1 P03956 1/20 0.68
MMP3 P08254 1/20 0.68
MMP7 P09237 1/20 0.68
MMP8 P22894 1/20 0.68

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
SCHEMBL3615957 1.00 MMP2 (0.77) MMP2MMP13MMP14MMP9ADAMTS4
SCHEMBL3616150 0.92 MMP2 (0.65) MMP2MMP13MMP14MMP9ADAMTS4
SCHEMBL3618262 0.91 MMP2 (0.82) MMP2MMP13MMP14MMP9ADAMTS4
SCHEMBL5802508 0.87 MMP2 (0.79) MMP2MMP13MMP14MMP9ADAMTS4
SCHEMBL3606959 0.87 MMP2 (0.79) MMP2MMP13MMP14MMP9ADAMTS4
SCHEMBL3609251 0.87 MMP2 (0.88) MMP2MMP13MMP14MMP9ADAMTS4
SCHEMBL3611937 0.87 MMP2 (1.00) MMP2MMP13MMP14MMP9ADAMTS4
SCHEMBL3619088 0.86 MMP2 (1.00) MMP2MMP13MMP14MMP9ADAMTS4
SCHEMBL3619093 0.86 MMP2 (1.00) MMP2MMP13MMP14MMP9ADAMTS4
SCHEMBL3616918 0.86 MMP2 (1.00) MMP2MMP13MMP14MMP9ADAMTS4

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-1692124-A1 BIARYL SULFONAMIDES AS MMP INHIBITORS Wyeth (US) 2006-08-23 EP claimed
WO-2005061477-A1 BIARYL SULFONAMIDES AS MMP INHIBITORS WYETH (US) 2005-07-07 WO claimed