SCHEMBL7315318

SCHEMBL7315318

COc1ccc(S(=O)(=O)c2c(C)cc(C(=O)NO)c(Cc3ccccc3)c2N)cc1

nearest known ligand 0.52

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
MMP13 P45452 17/20 0.52
MMP1 P03956 16/20 0.52
MMP9 P14780 18/20 0.51
MMP12 P39900 6/20 0.51
MMP2 P08253 5/20 0.51
MMP8 P22894 5/20 0.51
MMP14 P50281 5/20 0.51
MMP16 P51512 5/20 0.51
MMP3 P08254 4/20 0.48
ADAM17 P78536 4/20 0.46

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
SCHEMBL7321858 0.90 RAPGEF4 (0.47) MMP13MMP1MMP9MMP12MMP2
SCHEMBL7323945 0.86 MMP13 (0.56) MMP13MMP1MMP9MMP12MMP2
SCHEMBL7317489 0.86 KEAP1 (0.49) MMP13MMP1MMP9MMP12MMP2
SCHEMBL7323907 0.84 MMP13 (0.56) MMP13MMP1MMP9MMP12MMP2
SCHEMBL7318272 0.83 MMP13 (0.60) MMP13MMP1MMP9MMP12MMP2
SCHEMBL7321902 0.82 MMP13 (0.56) MMP13MMP1MMP9MMP12MMP2
SCHEMBL7323355 0.82 MMP13 (0.55) MMP13MMP1MMP9MMP12MMP2
SCHEMBL7316165 0.81 MMP9 (0.48) MMP13MMP1MMP9MMP12MMP2
SCHEMBL7313502 0.81 MMP13 (0.52) MMP13MMP1MMP9MMP12MMP2
SCHEMBL7323399 0.81 MMP9 (0.49) MMP13MMP1MMP9MMP12MMP2

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
US-5929097-A INHIBIT TUMOR NECROSIS FACTOR-ALPHA CONVERTING ENZYME AMERICAN CYANAMID COMPANY (US) 1999-07-27 US disclosed