SCHEMBL29212232

SCHEMBL29212232

Cn1c(=O)c(=O)[nH]c2cc(Cl)c(Cl)cc21

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GRIA1 P42261 8/20 1.00
GRIA2 P42262 8/20 1.00
GRIA3 P42263 8/20 1.00
GRIA4 P48058 8/20 1.00
GRIN2D O15399 8/20 0.54
GRIN3B O60391 8/20 0.54
GRIN1 Q05586 8/20 0.54
GRIN2A Q12879 8/20 0.54
GRIN2B Q13224 8/20 0.54
GRIN2C Q14957 8/20 0.54
GRIN3A Q8TCU5 8/20 0.54
LMNA P02545 3/20 0.52
MEN1 O00255 2/20 0.52
CYP1A2 P05177 2/20 0.52
TSHR P16473 2/20 0.52
BLM P54132 2/20 0.52
PMP22 Q01453 2/20 0.52
KMT2A Q03164 2/20 0.52
SMN1; SMN2 Q16637 2/20 0.52
KDM4E B2RXH2 1/20 0.52

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
SCHEMBL21949134 0.88 GRIA1 (0.78) GRIA1GRIA2GRIA3GRIA4GRIN2D
SCHEMBL21848256 0.86 GRIA1 (0.76) GRIA1GRIA2GRIA3GRIA4GRIN2D
SCHEMBL15730579 0.81 GRIA1 (0.68) GRIA1GRIA2GRIA3GRIA4GRIN2D
SCHEMBL30898295 0.79 GRIA1 (0.66) GRIA1GRIA2GRIA3GRIA4GRIN2D
SCHEMBL29212235 0.79 GRIA1 (0.66) GRIA1GRIA2GRIA3GRIA4GRIN2D
SCHEMBL9398023 0.79 GRIA1 (0.65) GRIA1GRIA2GRIA3GRIA4GRIN2D
SCHEMBL9395750 0.79 GRIA1 (0.65) GRIA1GRIA2GRIA3GRIA4GRIN2D
SCHEMBL4704409 0.78 GRIA1 (0.64) GRIA1GRIA2GRIA3GRIA4GRIN2D
SCHEMBL4704910 0.78 GRIA1 (0.64) GRIA1GRIA2GRIA3GRIA4GRIN2D
SCHEMBL22292503 0.77 GRIA1 (0.63) 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
CN-118047727-A Method for preparing quinoxaline-2, 3-diketone compound by virtue of regioselective photocatalytic oxidation 浙江工业大学台州研究院 2024-05-17 CN disclosed