SCHEMBL7426236

SCHEMBL7426236

CS(=O)(=O)N1CCC[C@@H]1[C@H](CS(=O)(=O)c1ccc(Oc2ccc(OC(F)(F)F)cc2)cc1)C(N)=O

nearest known ligand 0.68

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
MMP9 P14780 20/20 0.68
MMP2 P08253 18/20 0.68
MMP1 P03956 9/20 0.68
MMP14 P50281 1/20 0.43

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
SCHEMBL7999031 0.89 MMP9 (0.66) MMP9MMP2MMP1MMP14
SCHEMBL7598899 0.89 MMP9 (0.66) MMP9MMP2MMP1MMP14
SCHEMBL7999034 0.81 MMP9 (1.00) MMP9MMP2MMP1
SCHEMBL7598904 0.81 MMP9 (1.00) MMP9MMP2MMP1
SCHEMBL7426245 0.81 MMP9 (0.70) MMP9MMP2MMP1
SCHEMBL7599808 0.79 MMP9 (0.55) MMP9MMP2MMP1MMP14
SCHEMBL8000592 0.74 MMP9 (0.52) MMP9MMP2MMP1MMP14
SCHEMBL7990004 0.69 EPHX2 (0.48) MMP9MMP2MMP1MMP14
SCHEMBL7583731 0.69 MMP9 (0.45) MMP9MMP2MMP1MMP14
SCHEMBL7598896 0.68 MMP9 (0.64) MMP9MMP2MMP1MMP14

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