SCHEMBL8437480

SCHEMBL8437480

CCOC1=NS(=O)(=O)c2ccccc21

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PKM P14618 1/20 1.00
ALDH1A1 P00352 4/20 0.58
GAA P10253 3/20 0.56
HSD17B10 Q99714 3/20 0.56
LMNA P02545 2/20 0.56
HTT P42858 1/20 0.56
KDM4E B2RXH2 2/20 0.52
THRB P10828 1/20 0.52
ALOX15 P16050 1/20 0.52
RECQL P46063 1/20 0.52
TDP1 Q9NUW8 1/20 0.52
MAPT P10636 1/20 0.50
NPSR1 Q6W5P4 1/20 0.50
L3MBTL1 Q9Y468 1/20 0.50
RAB9A P51151 2/20 0.47
KCNA3 P22001 3/20 0.46
HPGD P15428 1/20 0.44
NPC1 O15118 2/20 0.42
MEN1 O00255 1/20 0.42
TP53 P04637 1/20 0.42

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
SCHEMBL6910103 0.87 PKM (0.77) PKMALDH1A1GAAHSD17B10LMNA
SCHEMBL6243131 0.84 PKM (0.72) PKMALDH1A1GAAHSD17B10LMNA
SCHEMBL11024449 0.80 HSD17B10 (0.71) PKMALDH1A1GAAHSD17B10LMNA
SCHEMBL8439404 0.80 PKM (0.66) PKMALDH1A1GAAHSD17B10LMNA
SCHEMBL7738030 0.80 ALDH1A1 (0.79) PKMALDH1A1GAAHSD17B10LMNA
Probenazol SCHEMBL23516 0.79 PKM (0.65) PKMALDH1A1GAAHSD17B10LMNA
Probenazol SCHEMBL30425932 0.79 PKM (0.65) PKMALDH1A1GAAHSD17B10LMNA
Probenazol SCHEMBL8409812 0.79 PKM (0.65) PKMALDH1A1GAAHSD17B10LMNA
SCHEMBL10910212 0.78 PKM (0.63) PKMALDH1A1GAAHSD17B10LMNA
SCHEMBL10910315 0.78 PKM (0.63) PKMALDH1A1GAAHSD17B10LMNA

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-5952282-A ADDING A 1,1-DIOXIDE, 3-(SUBSTITUTED AMINO)-1,2-BENZOISOTHIAZOLE COMPOUND TO BLEACH AS A BLEACH CATALYST CLARIANT GMBH (DE) 1999-09-14 US disclosed