SCHEMBL7215410

SCHEMBL7215410

CCCCOc1ccc(S(=O)(=O)CC(C(=O)NO)C(O)N2C(=O)CN(CCCC)C2=O)cc1

nearest known ligand 0.46

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
MMP7 P09237 9/20 0.46
MMP1 P03956 9/20 0.44
MMP13 P45452 8/20 0.42
MMP9 P14780 5/20 0.42
ADAM17 P78536 2/20 0.42
MMP3 P08254 8/20 0.41
MMP2 P08253 3/20 0.40
MMP14 P50281 2/20 0.40
ADAMTS4 O75173 1/20 0.40
ADAMTS5 Q9UNA0 1/20 0.40
MMP8 P22894 3/20 0.39

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
SCHEMBL7212175 0.73 MMP7 (0.48) MMP7MMP1MMP13MMP9ADAM17
SCHEMBL7210645 0.69 MMP7 (0.44) MMP7MMP1MMP13MMP9ADAM17
SCHEMBL6789471 0.69 HDAC6 (0.41) MMP7MMP1MMP13MMP9ADAM17
SCHEMBL6790741 0.69 MMP2 (0.40) MMP7MMP1MMP13MMP9MMP3
SCHEMBL7215322 0.65 MMP7 (0.51) MMP7MMP1MMP13MMP9ADAM17
SCHEMBL6376455 0.64 MMP1 (0.45) MMP7MMP1MMP13MMP9ADAM17
SCHEMBL7417303 0.63 MMP1 (0.68) MMP7MMP1MMP13MMP9ADAM17
SCHEMBL8108645 0.63 MMP1 (0.70) MMP7MMP1MMP13MMP9ADAM17
SCHEMBL8441790 0.63 MMP13 (0.55) MMP7MMP1MMP13MMP9ADAM17
SCHEMBL7411093 0.63 MMP13 (0.60) MMP7MMP1MMP13MMP9ADAM17

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
EP-1037868-B1 $g(a)-HYDROXY, -AMINO, AND HALO DERIVATIVES OF $g(b)-SULFONYL HYDROXAMIC ACIDS AS MATRIX METALLOPROTEINASES INHIBITORS UPJOHN CO (US) 2003-02-05 EP claimed