SCHEMBL7830179

SCHEMBL7830179

CCc1cc(N(C)C(=O)C=Cc2cc(C)c(NCS(=O)(=O)c3ccc(OC)cc3)c(C(=O)NO)c2)ccn1

nearest known ligand 0.38

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
MMP13 P45452 16/20 0.38
MMP1 P03956 15/20 0.38
MMP9 P14780 15/20 0.38
ADAM17 P78536 10/20 0.38
MMP12 P39900 1/20 0.36
TRPM8 Q7Z2W7 1/20 0.34
LMNA P02545 1/20 0.34

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
SCHEMBL7316088 0.84 MMP13 (0.45) MMP13MMP1MMP9ADAM17MMP12
SCHEMBL7820104 0.84 MMP13 (0.45) MMP13MMP1MMP9ADAM17MMP12
SCHEMBL7830182 0.83 TRPM8 (0.48) MMP13MMP1MMP9ADAM17MMP12
SCHEMBL7453309 0.80 MEN1 (0.44) MMP13MMP1MMP9ADAM17MMP12
SCHEMBL7820002 0.79 PTGS2 (0.41) MMP13MMP1MMP9ADAM17MMP12
SCHEMBL7323574 0.76 LMNA (0.43) MMP13MMP1MMP9ADAM17TRPM8
SCHEMBL7319845 0.76 PTGS2 (0.41) MMP13MMP1MMP9ADAM17TRPM8
SCHEMBL7318219 0.74 MMP13 (0.56) MMP13MMP1MMP9ADAM17MMP12
SCHEMBL6815791 0.72 MMP13 (0.60) MMP13MMP1MMP9ADAM17MMP12
SCHEMBL7820004 0.72 TAS1R3 (0.43) MMP13MMP1MMP9ADAM17MMP12

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-0938471-B1 THE PREPARATION AND USE OF ORTHO-SULFONAMIDO ARYL HYDROXAMIC ACIDS AS MATRIX METALLOPROTEINASE AND TACE INHIBITORS AMERICAN CYANAMID CO (US) 2001-12-12 EP claimed