SCHEMBL8446265

SCHEMBL8446265

O=C(O)[C@@H](Cc1c[nH]c2ccccc12)NS(=O)(=O)c1ccc(C#CCCCCc2ncc[nH]2)cc1

nearest known ligand 0.67

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
MMP9 P14780 14/20 0.67
MMP2 P08253 13/20 0.67
ADAM17 P78536 2/20 0.60
KCNA5 P22460 1/20 0.58
MMP3 P08254 1/20 0.51
MEN1 O00255 1/20 0.51
POLB P06746 1/20 0.51
KMT2A Q03164 1/20 0.51

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
SCHEMBL8451018 0.92 KCNA5 (0.61) MMP9MMP2ADAM17KCNA5
SCHEMBL8446620 0.86 MMP9 (0.74) MMP9MMP2ADAM17KCNA5
SCHEMBL8445641 0.82 MMP9 (0.77) MMP9MMP2ADAM17KCNA5
SCHEMBL8448379 0.81 MMP9 (0.66) MMP9MMP2ADAM17KCNA5
SCHEMBL8446523 0.80 MMP9 (0.92) MMP9MMP2ADAM17KCNA5
SCHEMBL8445610 0.79 MMP2 (0.52) MMP9MMP2ADAM17MMP3
SCHEMBL8446559 0.78 MMP9 (1.00) MMP9MMP2ADAM17KCNA5
SCHEMBL8446521 0.78 MMP9 (1.00) MMP9MMP2ADAM17KCNA5
SCHEMBL8450882 0.78 KCNA5 (0.62) MMP9MMP2ADAM17KCNA5
SCHEMBL8668400 0.78 KCNA5 (0.67) MMP9MMP2ADAM17KCNA5

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 2 patents. claimed = in the patent's claims; disclosed = body only.

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