SCHEMBL8600630

SCHEMBL8600630

COC(=O)c1cn(S(=O)(=O)c2ccc(OC)c(OC)c2)c2ccccc12

nearest known ligand 0.72

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.72
KMT2A Q03164 2/20 0.72
HTR6 P50406 6/20 0.61
LMNA P02545 3/20 0.53
SMN1; SMN2 Q16637 3/20 0.53
GAA P10253 1/20 0.53
HTT P42858 1/20 0.53
PLK1 P53350 1/20 0.52
PDE4A P27815 1/20 0.52
PDE4B Q07343 1/20 0.52
PDE4C Q08493 1/20 0.52
PDE4D Q08499 1/20 0.52
NR4A2 P43354 2/20 0.50
MAPT P10636 2/20 0.50
AKR1C3 P42330 1/20 0.50
AKR1C1 Q04828 1/20 0.50
L3MBTL1 Q9Y468 1/20 0.50
HDAC1 Q13547 1/20 0.50
HDAC2 Q92769 1/20 0.50
HDAC6 Q9UBN7 1/20 0.50

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
SCHEMBL8601386 0.89 AKR1C3 (0.64) MEN1KMT2AHTR6LMNASMN1; SMN2
SCHEMBL2886421 0.84 KMT2A (1.00) MEN1KMT2AHTR6LMNASMN1; SMN2
SCHEMBL27958054 0.83 MEN1 (0.83) MEN1KMT2AHTR6LMNASMN1; SMN2
SCHEMBL6285571 0.80 HTR6 (0.55) MEN1KMT2AHTR6LMNASMN1; SMN2
SCHEMBL6285576 0.80 HTR6 (0.55) MEN1KMT2AHTR6LMNASMN1; SMN2
SCHEMBL4815832 0.78 HTR6 (0.75) HTR6PDE4APDE4BPDE4CPDE4D
SCHEMBL6284042 0.77 HTR6 (0.53) MEN1KMT2AHTR6LMNASMN1; SMN2
SCHEMBL6281043 0.77 HTR6 (0.51) MEN1KMT2AHTR6LMNASMN1; SMN2
SCHEMBL6284046 0.77 HTR6 (0.53) MEN1KMT2AHTR6LMNASMN1; SMN2
SCHEMBL6281048 0.77 HTR6 (0.51) MEN1KMT2AHTR6LMNASMN1; SMN2

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-5728712-A 3,4-disubstituted-phenylsulphonamides and their therapeutic use CHIROSCIENCE LIMITED (GB) 1998-03-17 US disclosed