SCHEMBL9703575

SCHEMBL9703575

CCOC(=O)c1nc2cc(Cl)c(Cl)cc2[nH]c1=O

nearest known ligand 0.63

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GRIN2D O15399 3/20 0.63
GRIN3B O60391 3/20 0.63
GRIA1 P42261 3/20 0.63
GRIA2 P42262 3/20 0.63
GRIA3 P42263 3/20 0.63
GRIA4 P48058 3/20 0.63
GRIN1 Q05586 3/20 0.63
GRIN2A Q12879 3/20 0.63
GRIN2B Q13224 3/20 0.63
GRIN2C Q14957 3/20 0.63
GRIN3A Q8TCU5 3/20 0.63
GRIK1 P39086 2/20 0.63
GRIK2 Q13002 2/20 0.63
GRIK3 Q13003 2/20 0.63
GRIK4 Q16099 2/20 0.63
GRIK5 Q16478 2/20 0.63
LMNA P02545 1/20 0.63
GLP1R P43220 1/20 0.55
GAA P10253 1/20 0.47
HTT P42858 1/20 0.47

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
SCHEMBL6376356 0.90 GRIN2D (0.51) GRIN2DGRIN3BGRIA1GRIA2GRIA3
SCHEMBL11258206 0.90 GRIN2D (0.51) GRIN2DGRIN3BGRIA1GRIA2GRIA3
SCHEMBL11369648 0.90 GRIN2D (0.51) GRIN2DGRIN3BGRIA1GRIA2GRIA3
SCHEMBL6705309 0.86 ALDH1A1 (0.46) GRIN2DGRIN3BGRIA1GRIA2GRIA3
SCHEMBL6603120 0.86 GLP1R (0.50) GRIN2DGRIN3BGRIA1GRIA2GRIA3
SCHEMBL11363308 0.85 GRIN2D (0.62) GRIN2DGRIN3BGRIA1GRIA2GRIA3
SCHEMBL11256884 0.85 GRIN2D (0.68) GRIN2DGRIN3BGRIA1GRIA2GRIA3
SCHEMBL9704059 0.84 ADORA3 (0.55) GLP1RSIRT2SIRT1SIRT3HRH4
SCHEMBL30623229 0.84 ADORA3 (0.55) GLP1RSIRT2SIRT1SIRT3HRH4
SCHEMBL6377225 0.84 SIRT2 (0.56) SIRT2SIRT1SIRT3

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 12 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4264600-A VIRICIDES ELI LILLY AND COMPANY (US) 1981-04-28 US claimed
EP-0020836-A1 Antiviral combinations ELI LILLY AND COMPANY (US) 1981-01-07 EP claimed
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
US-4355030-A Antiviral combinations ELI LILLY AND COMPANY (US) 1982-10-19 US disclosed
US-4289773-A ETHYL 6,7-DIBROMO-3,4-DIHYDRO-3-OXOQUINOXALINE CARBOXYLATE AND A HINDERED AMINE ELI LILLY AND COMPANY (US) 1981-09-15 US disclosed
EP-0029658-A1 Salts of dihalo-2-quinoxaline carboxylic acids, their preparation and pharmaceutical formulations containing them ELI LILLY AND COMPANY (US) 1981-06-03 EP disclosed
US-4271162-A ETHYL 6,7-DICHLORO-3,4-DIHYDRO-3-ONOQUINOXALINE CARBOXYLATE AND 1-AMINOADAMANTANE ELI LILLY AND COMPANY (US) 1981-06-02 US disclosed
US-4264600-A VIRICIDES ELI LILLY AND COMPANY (US) 1981-04-28 US disclosed
US-4252954-A VIRICIDES ELI LILLY AND COMPANY (US) 1981-02-24 US disclosed
EP-0020836-A1 Antiviral combinations ELI LILLY AND COMPANY (US) 1981-01-07 EP disclosed
US-4210647-A INFLUENZA VIRUS, ETHYL 6,7-DIBROMO-3,4-DIHYDRO-3-OXO-2-QUINOXALINECARBOXYLATE, 1-AMINOADAMANTANE ELI LILLY AND COMPANY (US) 1980-07-01 US disclosed
EP-0010426-A1 Pharmaceutical composition containing 3,4-dihydro-3-oxo-2-quinoxalines, novel such quinoxalines and processes for the production thereof ELI LILLY AND COMPANY (US) 1980-04-30 EP disclosed