SCHEMBL8448255

SCHEMBL8448255

COC(=O)[C@@H](Cc1c[nH]c2ccccc12)NS(=O)(=O)c1ccc(C#Cc2ccc(C)cc2)cc1

nearest known ligand 0.82

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
MMP9 P14780 12/20 0.82
MMP2 P08253 11/20 0.82
KCNA5 P22460 5/20 0.71
KCNH2 Q12809 1/20 0.66
NR3C1 P04150 1/20 0.62
ADAM17 P78536 2/20 0.59

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
SCHEMBL8449351 1.00 MMP9 (0.82) MMP9MMP2KCNA5KCNH2NR3C1
SCHEMBL28340488 0.94 KCNA5 (0.78) MMP9MMP2KCNA5KCNH2NR3C1
SCHEMBL8448503 0.93 MMP9 (0.75) MMP9MMP2KCNA5KCNH2NR3C1
SCHEMBL8446521 0.90 MMP9 (1.00) MMP9MMP2KCNA5NR3C1ADAM17
SCHEMBL8446559 0.90 MMP9 (1.00) MMP9MMP2KCNA5NR3C1ADAM17
SCHEMBL8450863 0.90 KCNA5 (0.73) MMP9MMP2KCNA5KCNH2ADAM17
SCHEMBL8450960 0.89 MMP9 (0.71) MMP9MMP2KCNA5KCNH2ADAM17
SCHEMBL8448733 0.89 MMP9 (0.82) MMP9MMP2KCNA5NR3C1ADAM17
SCHEMBL8451106 0.88 MMP9 (0.67) MMP9MMP2KCNA5KCNH2ADAM17
SCHEMBL8451063 0.88 MMP9 (0.74) MMP9MMP2KCNA5KCNH2ADAM17

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-0915086-A1 PHENYLSULFONAMIDE DERIVATIVES ONO PHARMACEUTICAL CO., LTD. (JP) 1999-05-12 EP disclosed