SCHEMBL4556616

SCHEMBL4556616

Cc1cc(COc2ccc(S(=O)(=O)N[C@@H]3CCC[C@@]34NC(=O)NC4=O)cc2)c2ccccc2n1

nearest known ligand 0.70

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
ADAM17 P78536 5/20 0.69
MMP1 P03956 1/20 0.64
MMP2 P08253 1/20 0.64
MMP9 P14780 1/20 0.64
MMP13 P45452 1/20 0.64

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
SCHEMBL4053925 1.00 ADAM17 (0.69) ADAM17MMP1MMP2MMP9MMP13
SCHEMBL4053921 1.00 ADAM17 (0.69) ADAM17MMP1MMP2MMP9MMP13
SCHEMBL4057124 0.98 MMP1 (0.67) ADAM17MMP1MMP2MMP9MMP13
SCHEMBL4057122 0.98 MMP1 (0.67) ADAM17MMP1MMP2MMP9MMP13
SCHEMBL4563622 0.98 MMP1 (0.67) ADAM17MMP1MMP2MMP9MMP13
SCHEMBL4049537 0.88 ADAM17 (0.68) ADAM17MMP1MMP2MMP9MMP13
SCHEMBL4049542 0.88 ADAM17 (0.68) ADAM17MMP1MMP2MMP9MMP13
SCHEMBL4052488 0.87 ADAM17 (0.64) ADAM17MMP1MMP2MMP9MMP13
SCHEMBL4052492 0.87 ADAM17 (0.64) ADAM17MMP1MMP2MMP9MMP13
SCHEMBL4052634 0.87 MMP1 (0.65) ADAM17MMP1MMP2MMP9MMP13

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-1397137-B1 HYDANTION DERIVATIVES AS INHIBITORS OF MATRIX METALLOPROTEINASES BRISTOL MYERS SQUIBB CO (US) 2009-10-14 EP claimed