SCHEMBL8368403

SCHEMBL8368403

Cc1cn(-c2cc3c(cc2Cl)[nH]c(=O)c2nnc(CP(=O)(O)O)n23)c(C)n1

nearest known ligand 0.51

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
GRIN2D O15399 3/20 0.49
GRIN3B O60391 3/20 0.49
GRIA1 P42261 3/20 0.49
GRIA2 P42262 3/20 0.49
GRIA3 P42263 3/20 0.49
GRIA4 P48058 3/20 0.49
GRIN1 Q05586 3/20 0.49
GRIN2A Q12879 3/20 0.49
GRIN2B Q13224 3/20 0.49
GRIN2C Q14957 3/20 0.49
GRIN3A Q8TCU5 3/20 0.49

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
SCHEMBL8367770 0.87 GRIN2D (0.40) GRIN2DGRIN3BGRIA1GRIA2GRIA3
SCHEMBL8365182 0.87 GRIA1 (0.40) GRIN2DGRIN3BGRIA1GRIA2GRIA3
SCHEMBL8368402 0.87 GRIA1 (0.39) GRIN2DGRIN3BGRIA1GRIA2GRIA3
SCHEMBL8368460 0.84 GRIN2D (0.53) GRIN2DGRIN3BGRIA1GRIA2GRIA3
SCHEMBL8364546 0.79 GRIA1 (0.43) GRIN2DGRIN3BGRIA1GRIA2GRIA3
SCHEMBL8364708 0.79 GRIN2D (0.39) GRIN2DGRIN3BGRIA1GRIA2GRIA3
SCHEMBL8195327 0.79 GRIA1 (0.39) GRIN2DGRIN3BGRIA1GRIA2GRIA3
SCHEMBL8186918 0.76 KDM4E (0.37) GRIN2DGRIN3BGRIA1GRIA2GRIA3
SCHEMBL9080503 0.74 GRIN2D (0.48) GRIN2DGRIN3BGRIA1GRIA2GRIA3
SCHEMBL8364711 0.73 GRIA1 (0.38) GRIN2DGRIN3BGRIA1GRIA2GRIA3

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
US-6001832-A [1,2,4]triazolo[4,3-a]quinoxalinone derivatives, their preparation and use NOVO NORDISKALS (DK) 1999-12-14 US disclosed
EP-0783504-A1 [1,2,4]TRIAZOLO[4,3-a]QUINOXALINONE DERIVATIVES, THEIR PREPARATION AND USE NOVO NORDISK A/S (DK) 1997-07-16 EP disclosed
WO-1996008492-A1 [1,2,4]TRIAZOLO[4,3-a]QUINOXALINONE DERIVATIVES, THEIR PREPARATION AND USE NOVO NORDISK A/S (DK) 1996-03-21 WO disclosed