SCHEMBL9747505

SCHEMBL9747505

NS(=O)(=O)c1cc(S(N)(=O)=O)c2ccc3[nH]c(=O)c(=O)[nH]c3c2c1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.48
CYP2C19 P33261 2/20 0.48
TDP1 Q9NUW8 2/20 0.48
KDM4E B2RXH2 2/20 0.48
ALDH1A1 P00352 2/20 0.48
MEN1 O00255 1/20 0.48
GRM6 O15303 1/20 0.48
GLA P06280 1/20 0.48
THRB P10828 1/20 0.48
HPGD P15428 1/20 0.48
ALOX15 P16050 1/20 0.48
GRIK1 P39086 1/20 0.48
GRIA1 P42261 1/20 0.48
GRIA2 P42262 1/20 0.48
GRIA3 P42263 1/20 0.48
RECQL P46063 1/20 0.48
GRIA4 P48058 1/20 0.48
KMT2A Q03164 1/20 0.48
GRIK2 Q13002 1/20 0.48
GRIK3 Q13003 1/20 0.48

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
SCHEMBL9747279 0.79 MAPT (0.49) MAPTCYP2C19TDP1KDM4EALDH1A1
SCHEMBL9747625 0.79 KMT2A (0.56) MAPTCYP2C19TDP1KDM4EALDH1A1
SCHEMBL9747632 0.78 LMNA (0.45) MAPTCYP2C19TDP1KDM4EALDH1A1
SCHEMBL3682051 0.75 MAPT (0.62) MAPTCYP2C19TDP1KDM4EALDH1A1
SCHEMBL3670356 0.75 GRIA1 (0.72) MAPTCYP2C19TDP1KDM4EALDH1A1
SCHEMBL3683241 0.73 MAPT (0.45) MAPTCYP2C19TDP1KDM4EALDH1A1
SCHEMBL9747794 0.72 GRIN2D (0.45) MAPTCYP2C19TDP1KDM4EALDH1A1
Hydrochloric Acid SCHEMBL3683097 0.72 MAPT (0.44) MAPTCYP2C19TDP1KDM4EALDH1A1
SCHEMBL3687754 0.72 MAPT (0.62) MAPTCYP2C19TDP1KDM4EALDH1A1
SCHEMBL9747110 0.71 MAPT (0.42) MAPTCYP2C19TDP1KDM4EALDH1A1

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
EP-0511152-A2 Quinoxaline compounds, their preparation and use NOVO NORDISK A/S (DK) 1992-10-28 EP disclosed