SCHEMBL6689532

SCHEMBL6689532

CNc1cc(OS(=O)(=O)O)ccc1O

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 6/20 0.41
GAA P10253 2/20 0.41
GLA P06280 1/20 0.41
CISD1 Q9NZ45 1/20 0.38
IDO1 P14902 1/20 0.38
LMNA P02545 3/20 0.36
MEN1 O00255 3/20 0.36
KMT2A Q03164 3/20 0.36
TP53 P04637 2/20 0.36
HSD17B10 Q99714 2/20 0.36
HTT P42858 2/20 0.36
MAPT P10636 1/20 0.36
ADRA2A P08913 2/20 0.36
ADRA2B P18089 2/20 0.36
ADRA2C P18825 2/20 0.36
ADRA1A P35348 2/20 0.36
APP P05067 1/20 0.36
WDR5 P61964 1/20 0.35
TYR P14679 1/20 0.35
CYP3A4 P08684 1/20 0.35

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
SCHEMBL10448617 0.73 ALDH1A1 (0.53) ALDH1A1GAAGLACISD1LMNA
SCHEMBL30697784 0.72 MAPT (0.56) ALDH1A1CISD1LMNAMEN1KMT2A
SCHEMBL3381009 0.72 ALDH1A1 (0.55) ALDH1A1GAAGLALMNAMEN1
SCHEMBL10773617 0.71 TSHR (0.44) ALDH1A1GAAGLACISD1IDO1
SCHEMBL11299892 0.71 GAA (0.53) ALDH1A1GAAGLACISD1LMNA
SCHEMBL30274255 0.70 ALDH1A1 (0.54) ALDH1A1GAAGLAMEN1KMT2A
SCHEMBL11383141 0.70 ALDH1A1 (0.69) ALDH1A1GAAGLACISD1LMNA
SCHEMBL7910581 0.70 GLA (0.53) GAAGLACISD1
SCHEMBL24871084 0.69 ENPP2 (0.47) ALDH1A1IDO1LMNAMAPTADRA2A
SCHEMBL7163859 0.69 GAA (0.51) ALDH1A1GAAGLACISD1LMNA

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
WO-2004096986-A2 METHOD FOR QUANTITATIVE DETECTION OF NUCLEIC ACID MOLECULES INTEGRATED NANO-TECHNOLOGIES, LLC (US) 2004-11-11 WO disclosed