SCHEMBL8197834

SCHEMBL8197834

CCOC(O)([PH2]=O)c1nnc2c(=O)[nH]c3cc(C(F)(F)F)c(-n4cc(C)nc4CC)cc3n12

nearest known ligand 0.40

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
GRIA1 P42261 3/20 0.34
GRIA2 P42262 3/20 0.34
GRIA3 P42263 3/20 0.34
GRIA4 P48058 3/20 0.34
MEN1 O00255 1/20 0.34
KMT2A Q03164 1/20 0.34
GRIN2D O15399 1/20 0.32
GRIN3B O60391 1/20 0.32
GRIN1 Q05586 1/20 0.32
GRIN2A Q12879 1/20 0.32
GRIN2B Q13224 1/20 0.32
GRIN2C Q14957 1/20 0.32
GRIN3A Q8TCU5 1/20 0.32

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
SCHEMBL8197833 0.88 GRIA1 (0.34) GRIA1GRIA2GRIA3GRIA4MEN1
SCHEMBL8198097 0.88 MEN1 (0.37) GRIA1GRIA2GRIA3GRIA4MEN1
SCHEMBL8186583 0.82 MEN1 (0.36) GRIA1GRIA2GRIA3GRIA4MEN1
SCHEMBL8505663 0.81 MEN1 (0.33) GRIA1GRIA2GRIA3GRIA4MEN1
SCHEMBL8502814 0.80 GRIA1 (0.39) GRIA1GRIA2GRIA3GRIA4
SCHEMBL8186535 0.80 MEN1 (0.35) MEN1KMT2A
SCHEMBL8197835 0.80 GRIA1 (0.36) GRIA1GRIA2GRIA3GRIA4GRIN2D
SCHEMBL8185988 0.80 GRIA1 (0.36) GRIA1GRIA2GRIA3GRIA4GRIN2D
SCHEMBL8195327 0.79 GRIA1 (0.39) GRIA1GRIA2GRIA3GRIA4GRIN2D
SCHEMBL8368431 0.79 GRIA1 (0.42) 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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0783504-B1 [1,2,4]TRIAZOLO[4,3-a]QUINOXALINONE DERIVATIVES, THEIR PREPARATION AND USE AS ANTAGONISTS OF AMPA-RECEPTORS NOVO NORDISK AS (DK) 2000-03-15 EP claimed
EP-0783504-B1 [1,2,4]TRIAZOLO[4,3-a]QUINOXALINONE DERIVATIVES, THEIR PREPARATION AND USE AS ANTAGONISTS OF AMPA-RECEPTORS NOVO NORDISK AS (DK) 2000-03-15 EP disclosed
US-6001832-A [1,2,4]triazolo[4,3-a]quinoxalinone derivatives, their preparation and use NOVO NORDISKALS (DK) 1999-12-14 US disclosed