SCHEMBL8894957

SCHEMBL8894957

Cc1c([N+](=O)[O-])cc2[nH]c(=O)c(=O)[nH]c2c1CN(C)C(=O)c1cccc(Cl)c1Cl

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GRIA1 P42261 3/20 0.48
GRIA2 P42262 3/20 0.48
GRIA3 P42263 3/20 0.48
GRIA4 P48058 3/20 0.48
GRIN2D O15399 9/20 0.41
GRIN3B O60391 9/20 0.41
GRIN1 Q05586 9/20 0.41
GRIN2A Q12879 9/20 0.41
GRIN2B Q13224 9/20 0.41
GRIN2C Q14957 9/20 0.41
GRIN3A Q8TCU5 9/20 0.41
KMT2A Q03164 3/20 0.37
MAPK1 P28482 1/20 0.37
KDM4E B2RXH2 2/20 0.36
ALDH1A1 P00352 2/20 0.36
MAPT P10636 2/20 0.36
HPGD P15428 2/20 0.36
HSD17B10 Q99714 2/20 0.36
MEN1 O00255 1/20 0.36
GRM6 O15303 1/20 0.36

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
SCHEMBL7957898 0.83 GRIA1 (0.49) GRIA1GRIA2GRIA3GRIA4GRIN2D
SCHEMBL7948372 0.83 GRIA1 (0.51) GRIA1GRIA2GRIA3GRIA4GRIN2D
SCHEMBL7959292 0.82 GRIA1 (0.53) GRIA1GRIA2GRIA3GRIA4GRIN2D
SCHEMBL7958054 0.81 GRIA1 (0.56) GRIA1GRIA2GRIA3GRIA4GRIN2D
SCHEMBL7959733 0.80 ALDH1A1 (0.53) GRIA1GRIA2GRIA3GRIA4GRIN2D
SCHEMBL7948364 0.80 GRIA1 (0.49) GRIA1GRIA2GRIA3GRIA4GRIN2D
SCHEMBL7959487 0.79 GRIA1 (0.47) GRIA1GRIA2GRIA3GRIA4GRIN2D
SCHEMBL7948349 0.77 GRIA1 (0.48) GRIA1GRIA2GRIA3GRIA4GRIN2D
SCHEMBL7959924 0.77 GRIA1 (0.45) GRIA1GRIA2GRIA3GRIA4GRIN2D
SCHEMBL7957879 0.77 GRIA1 (0.51) GRIA1GRIA2GRIA3GRIA4GRIN2D

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-1997046539-A1 AMIDE DERIVATIVES OF SUBSTITUTED QUINOXALINE 2,3-DIONES AS GLUTAMATE RECEPTOR ANTAGONISTS WARNER-LAMBERT COMPANY (US) 1997-12-11 WO disclosed