SCHEMBL9812951

SCHEMBL9812951

CCOc1ccccc1CNS(=O)(=O)c1ccccc1

nearest known ligand 0.69

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
GAA P10253 1/20 0.69
TP53 P04637 4/20 0.62
KMT2A Q03164 4/20 0.60
LMNA P02545 3/20 0.60
MEN1 O00255 3/20 0.60
HTT P42858 2/20 0.60
ALDH1A1 P00352 1/20 0.60
PKM P14618 1/20 0.60
MAPK1 P28482 1/20 0.60
POLB P06746 2/20 0.53
KEAP1 Q14145 1/20 0.51
ATM Q13315 1/20 0.51
L3MBTL1 Q9Y468 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
SCHEMBL21550423 0.85 GAA (0.52) GAATP53LMNAHTTALDH1A1
SCHEMBL9812983 0.85 GAA (0.62) GAATP53KMT2ALMNAMEN1
SCHEMBL4661701 0.84 GAA (0.72) GAAKMT2ALMNAMEN1HTT
SCHEMBL29660937 0.84 GAA (0.72) GAAKMT2ALMNAMEN1HTT
SCHEMBL26921059 0.84 GAA (0.68) GAATP53KMT2ALMNAMEN1
SCHEMBL5165402 0.81 GAA (0.64) GAATP53KMT2ALMNAMEN1
SCHEMBL29540801 0.80 KEAP1 (0.70) GAAKMT2ALMNAMEN1ALDH1A1
SCHEMBL30927263 0.78 GAA (0.50) GAAKMT2ALMNAMEN1ALDH1A1
SCHEMBL7414750 0.76 KMT2A (0.54) GAATP53KMT2AMEN1HTT
SCHEMBL10774143 0.76 ALDH1A1 (0.55) GAATP53KMT2ALMNAMEN1

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-0223593-B1 PHENOXYALKYLCARBOXYLIC ACIDS AND ESTERS AND THEIR PREPARATION AND PHARMACEUTICAL FORMULATION GLAXO GROUP LIMITED (GB) 1991-08-07 EP disclosed
EP-0223593-A2 Phenoxyalkylcarboxylic acids and esters and their preparation and pharmaceutical formulation GLAXO GROUP LIMITED (GB) 1987-05-27 EP disclosed