SCHEMBL9747632

SCHEMBL9747632

NS(=O)(=O)c1ccc2c(ccc3[nH]c(=O)c(=O)[nH]c32)c1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.45
MAPT P10636 2/20 0.44
MEN1 O00255 2/20 0.43
ALDH1A1 P00352 2/20 0.43
HPGD P15428 2/20 0.43
ALOX15 P16050 2/20 0.43
KMT2A Q03164 2/20 0.43
HSD17B10 Q99714 2/20 0.43
KDM4E B2RXH2 1/20 0.43
GRM6 O15303 1/20 0.43
GLA P06280 1/20 0.43
THRB P10828 1/20 0.43
CYP2C19 P33261 1/20 0.43
GRIK1 P39086 1/20 0.43
GRIA1 P42261 1/20 0.43
GRIA2 P42262 1/20 0.43
GRIA3 P42263 1/20 0.43
RECQL P46063 1/20 0.43
GRIA4 P48058 1/20 0.43
GRIK2 Q13002 1/20 0.43

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 0.89 MAPT (0.49) LMNAMAPTMEN1ALDH1A1HPGD
SCHEMBL9747366 0.85 BRD4 (0.40) MAPTMEN1ALDH1A1HPGDALOX15
SCHEMBL9747703 0.80 ALDH1A1 (0.41) MAPTMEN1ALDH1A1HPGDALOX15
SCHEMBL3683241 0.78 MAPT (0.45) MAPTMEN1ALDH1A1HPGDALOX15
SCHEMBL9747505 0.78 MAPT (0.48) LMNAMAPTMEN1ALDH1A1HPGD
SCHEMBL31236067 0.77 TAS2R14 (0.61) MAPTMEN1ALDH1A1HPGDKMT2A
SCHEMBL8415280 0.77 TAS2R14 (0.61) MAPTMEN1ALDH1A1HPGDKMT2A
SCHEMBL9747794 0.77 GRIN2D (0.45) LMNAMAPTMEN1ALDH1A1HPGD
Hydrochloric Acid SCHEMBL3683097 0.77 MAPT (0.44) MAPTMEN1ALDH1A1HPGDALOX15
SCHEMBL12848788 0.74 GRIA1 (0.60) LMNAMAPTMEN1ALDH1A1HPGD

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