SCHEMBL28575720

SCHEMBL28575720

C=C(CN(c1ccc(C)cc1)S(=O)(=O)c1ccc(C)cc1)c1ccc(OC)cc1

nearest known ligand 0.62

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
KEAP1 Q14145 4/20 0.62
NFE2L2 Q16236 4/20 0.62
MAPT P10636 2/20 0.60
LMNA P02545 3/20 0.59
ALDH1A1 P00352 1/20 0.59
NPSR1 Q6W5P4 1/20 0.59
TP53 P04637 2/20 0.58
MEN1 O00255 2/20 0.57
KMT2A Q03164 2/20 0.57
POLB P06746 1/20 0.56
CNR1 P21554 1/20 0.56
CNR2 P34972 1/20 0.56
PPARG P37231 1/20 0.55

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
SCHEMBL28575718 0.84 KEAP1 (0.61) KEAP1NFE2L2MAPTMEN1KMT2A
SCHEMBL28563912 0.82 LMNA (0.52) KEAP1NFE2L2MAPTLMNAALDH1A1
SCHEMBL28561073 0.82 KEAP1 (0.61) KEAP1NFE2L2MAPTLMNAALDH1A1
SCHEMBL12533188 0.81 KEAP1 (0.76) KEAP1NFE2L2MAPTLMNAALDH1A1
SCHEMBL28567580 0.78 POLB (0.59) KEAP1NFE2L2MAPTALDH1A1TP53
SCHEMBL1629060 0.77 KEAP1 (1.00) KEAP1NFE2L2PPARG
SCHEMBL7821400 0.77 LMNA (0.72) KEAP1NFE2L2LMNAALDH1A1NPSR1
SCHEMBL31159441 0.76 LMNA (0.60) KEAP1NFE2L2MAPTLMNAALDH1A1
SCHEMBL7003143 0.75 KEAP1 (0.71) KEAP1NFE2L2MAPTLMNAALDH1A1
SCHEMBL28564469 0.74 LMNA (0.54) KEAP1NFE2L2MAPTLMNAALDH1A1

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
CN-109336792-B Synthesis method of 4-methyl-N-phenyl-N- (2-phenylallyl) benzene sulfonamide compound 山东理工大学 2021-01-05 CN disclosed