SCHEMBL9705689

SCHEMBL9705689

O=C(O)c1nc2ccc(Cl)c(Cl)c2[nH]c1=O

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GRIN2D O15399 2/20 0.55
GRIN3B O60391 2/20 0.55
GRIK1 P39086 2/20 0.55
GRIA1 P42261 2/20 0.55
GRIA2 P42262 2/20 0.55
GRIA3 P42263 2/20 0.55
GRIA4 P48058 2/20 0.55
GRIN1 Q05586 2/20 0.55
GRIN2A Q12879 2/20 0.55
GRIK2 Q13002 2/20 0.55
GRIK3 Q13003 2/20 0.55
GRIN2B Q13224 2/20 0.55
GRIN2C Q14957 2/20 0.55
GRIK4 Q16099 2/20 0.55
GRIK5 Q16478 2/20 0.55
GRIN3A Q8TCU5 2/20 0.55
LMNA P02545 1/20 0.55
DYRK1A Q13627 6/20 0.42
CDK9 P50750 4/20 0.42
DYRK2 Q92630 2/20 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
SCHEMBL9705025 0.79 GLP1R (0.44) LMNAALDH1A1MAPTSMN1; SMN2HPGD
SCHEMBL9704091 0.77 GRIN2D (0.67) GRIN2DGRIN3BGRIK1GRIA1GRIA2
SCHEMBL9704255 0.75 GRIN2D (0.55) GRIN2DGRIN3BGRIK1GRIA1GRIA2
SCHEMBL9704489 0.72 GRIN2D (0.68) GRIN2DGRIN3BGRIK1GRIA1GRIA2
SCHEMBL31123058 0.72 DYRK1A (0.58) GRIN2DGRIN3BGRIK1GRIA1GRIA2
6,7-Dichloro-3-Hydroxy-2-Quinoxalinecarboxylic Acid SCHEMBL6697845 0.71 GRIN2D (1.00) GRIN2DGRIN3BGRIK1GRIA1GRIA2
SCHEMBL1625968 0.70 HCAR1 (0.33) CSNK2A2CSNK2BCSNK2A1
SCHEMBL9704358 0.69 GRIN2D (0.68) GRIN2DGRIN3BGRIK1GRIA1GRIA2
SCHEMBL7045265 0.67 HTR3E (0.47) ALDH1A1
SCHEMBL3421751 0.67 ALDH1A1 (0.47) LMNACSNK2A1ALDH1A1MAPTHTT

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-1992011245-A1 2-ACYLAMIDO DERIVATIVES OF 3,4-DIHYDRO-3-OXO-QUINOXALINE HAVING PHARMACEUTICAL ACTIVITY WARNER-LAMBERT COMPANY (US) 1992-07-09 WO disclosed