SCHEMBL8446563

SCHEMBL8446563

C[C@H](C(=O)OC(C)(C)C)N(C(=O)OC(C)(C)C)S(=O)(=O)c1ccc(O[SiH2]C(F)(F)F)cc1

nearest known ligand 0.36

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
MMP13 P45452 2/20 0.36
BMP1 P13497 4/20 0.35
KEAP1 Q14145 5/20 0.34
NFE2L2 Q16236 2/20 0.34
AOC2 O75106 1/20 0.32
PDK2 Q15119 1/20 0.31
KDM4E B2RXH2 1/20 0.31

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
SCHEMBL8450038 0.80 NPSR1 (0.36) MMP13BMP1
SCHEMBL8445750 0.75 MMP9 (0.42) MMP13
SCHEMBL8446548 0.72 HAO1 (0.35) MMP13
SCHEMBL8450891 0.70 POLB (0.35) MMP13
SCHEMBL8450888 0.70 POLB (0.35) MMP13
SCHEMBL31219817 0.69 ALDH1A1 (0.42) MMP13
SCHEMBL3091945 0.65 MMP2 (0.44) MMP13BMP1KEAP1NFE2L2
SCHEMBL6498314 0.64 ADAMTS4 (0.47) MMP13KEAP1NFE2L2
SCHEMBL22718351 0.64 NPSR1 (0.37) BMP1
SCHEMBL29603329 0.64 NPSR1 (0.37) BMP1

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