SCHEMBL7320157

SCHEMBL7320157

COc1ccc(S(=O)(=O)[N]c2c(C)cccc2C(=O)NO)cc1

nearest known ligand 0.55

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
MMP13 P45452 17/20 0.55
MMP9 P14780 16/20 0.55
MMP1 P03956 15/20 0.55
MMP2 P08253 3/20 0.55
MMP8 P22894 3/20 0.55
MMP12 P39900 3/20 0.55
MMP14 P50281 3/20 0.55
MMP16 P51512 3/20 0.55
ADAM17 P78536 7/20 0.53
MMP3 P08254 2/20 0.52
FFAR4 Q5NUL3 1/20 0.46
CA1 P00915 1/20 0.46
CA2 P00918 1/20 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
SCHEMBL7320167 0.78 FFAR4 (0.70) MMP13MMP9MMP1MMP2MMP8
SCHEMBL7323902 0.71 MMP13 (1.00) MMP13MMP9MMP1ADAM17
SCHEMBL7313705 0.71 MMP13 (0.74) MMP13MMP9MMP1ADAM17
SCHEMBL7443729 0.70 MMP13 (1.00) MMP13MMP9MMP1ADAM17
SCHEMBL7325101 0.69 MMP13 (0.84) MMP13MMP9MMP1ADAM17
SCHEMBL5898955 0.68 MMP9 (0.62) MMP13MMP9MMP1MMP2MMP8
SCHEMBL7324037 0.68 MMP9 (0.70) MMP13MMP9MMP1MMP2MMP8
SCHEMBL5159892 0.67 FFAR4 (0.74) ADAM17FFAR4
SCHEMBL7322031 0.67 FFAR4 (0.74) ADAM17FFAR4
SCHEMBL7318221 0.66 MMP13 (0.83) MMP13MMP9MMP1ADAM17

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