SCHEMBL9703518

SCHEMBL9703518

C=CCOc1cc2cc(Cl)c(Cl)cc2nc1C(=O)O

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GAA P10253 2/20 0.47
TSHR P16473 1/20 0.47
GRIN2D O15399 1/20 0.40
GRIN3B O60391 1/20 0.40
LMNA P02545 1/20 0.40
GRIK1 P39086 1/20 0.40
GRIA1 P42261 1/20 0.40
GRIA2 P42262 1/20 0.40
GRIA3 P42263 1/20 0.40
GRIA4 P48058 1/20 0.40
GRIN1 Q05586 1/20 0.40
GRIN2A Q12879 1/20 0.40
GRIK2 Q13002 1/20 0.40
GRIK3 Q13003 1/20 0.40
GRIN2B Q13224 1/20 0.40
GRIN2C Q14957 1/20 0.40
GRIK4 Q16099 1/20 0.40
GRIK5 Q16478 1/20 0.40
GRIN3A Q8TCU5 1/20 0.40
HTR2A P28223 2/20 0.35

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
SCHEMBL9703450 0.82 GAA (0.43) GAATSHRGRIN2DGRIN3BLMNA
SCHEMBL9703948 0.71 ATM (0.37) GAATSHRGRIN2DGRIN3BLMNA
SCHEMBL2478229 0.68 GAA (0.61) GAATSHRLMNAHTR2AHTR2C
SCHEMBL20677871 0.68 GAA (0.66) GAATSHRHTR2AHTR2CHTR2B
SCHEMBL28911160 0.67 GRIN2D (0.47) GRIN2DGRIN3BLMNAGRIK1GRIA1
SCHEMBL8460563 0.67 TSHR (0.60) GAATSHRLMNATP53NPC1
SCHEMBL9704210 0.67 PGK1 (0.36) GAATSHRGRIN2DGRIN3BLMNA
SCHEMBL29200011 0.66 GAA (0.67) GAATSHRTP53PTGDRPTGDR2
SCHEMBL8168167 0.66 TSHR (0.68) GAATSHRTP53LIG1KDM4E
SCHEMBL30826232 0.65 HTR2C (0.51) GAATSHRLMNAHTR2AHTR2C

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