SCHEMBL8505683

SCHEMBL8505683

CC(C)c1nccn1-c1cc2c(cc1C(F)(F)F)[nH]c(=O)c1nnc(CP(=O)(O)O)n12

nearest known ligand 0.40

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
GRIA1 P42261 3/20 0.36
GRIA2 P42262 3/20 0.36
GRIA3 P42263 3/20 0.36
GRIA4 P48058 3/20 0.36
GRIN2D O15399 1/20 0.36
GRIN3B O60391 1/20 0.36
GRIN1 Q05586 1/20 0.36
GRIN2A Q12879 1/20 0.36
GRIN2B Q13224 1/20 0.36
GRIN2C Q14957 1/20 0.36
GRIN3A Q8TCU5 1/20 0.36
GRIK1 P39086 1/20 0.33
GRIK2 Q13002 1/20 0.33
GRIK3 Q13003 1/20 0.33
GRIK4 Q16099 1/20 0.33
GRIK5 Q16478 1/20 0.33

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
SCHEMBL8505651 0.91 GRIA1 (0.35) GRIA1GRIA2GRIA3GRIA4GRIN2D
SCHEMBL8365182 0.80 GRIA1 (0.40) GRIA1GRIA2GRIA3GRIA4GRIN2D
SCHEMBL8505399 0.80 GRIA1 (0.43) GRIA1GRIA2GRIA3GRIA4GRIK1
SCHEMBL8195327 0.79 GRIA1 (0.39) GRIA1GRIA2GRIA3GRIA4GRIN2D
SCHEMBL8911215 0.79 GRIA1 (0.35) GRIA1GRIA2GRIA3GRIA4GRIK1
SCHEMBL8505662 0.79 MEN1 (0.34) GRIA1GRIA2GRIA3GRIA4GRIK1
SCHEMBL8364825 0.78 GRIA1 (0.39) GRIA1GRIA2GRIA3GRIA4GRIN2D
SCHEMBL8195326 0.78 GRIA1 (0.38) GRIA1GRIA2GRIA3GRIA4GRIN2D
SCHEMBL8505663 0.78 MEN1 (0.33) GRIA1GRIA2GRIA3GRIA4GRIK1
SCHEMBL8368328 0.77 RIOK2 (0.41) 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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0781282-B1 [1,2,4]TRIAZOLO[4,3-a]QUINOXALINONE DERIVATIVES, THEIR PREPARATION AND USE NOVO NORDISK AS (DK) 1999-08-11 EP claimed
EP-0781282-B1 [1,2,4]TRIAZOLO[4,3-a]QUINOXALINONE DERIVATIVES, THEIR PREPARATION AND USE NOVO NORDISK AS (DK) 1999-08-11 EP disclosed