SCHEMBL8553609

SCHEMBL8553609

Cc1c(C(C)C(=O)O)nc2c(=O)[nH]c3cc(C(F)(F)F)c(Cl)cc3n12

nearest known ligand 0.41

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
GRIA1 P42261 3/20 0.38
GRIA2 P42262 3/20 0.38
GRIA3 P42263 3/20 0.38
GRIA4 P48058 3/20 0.38
GRIN2D O15399 2/20 0.38
GRIN3B O60391 2/20 0.38
GRIN1 Q05586 2/20 0.38
GRIN2A Q12879 2/20 0.38
GRIN2B Q13224 2/20 0.38
GRIN2C Q14957 2/20 0.38
GRIN3A Q8TCU5 2/20 0.38
EGLN1 Q9GZT9 1/20 0.36

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
SCHEMBL8560788 0.83 GRIN2D (0.43) GRIA1GRIA2GRIA3GRIA4GRIN2D
SCHEMBL8556101 0.81 GRIN2D (0.39) GRIA1GRIA2GRIA3GRIA4GRIN2D
SCHEMBL8553602 0.79 PDE5A (0.41) GRIA1GRIA2GRIA3GRIA4GRIN2D
SCHEMBL8555550 0.77 CHEK1 (0.56)
SCHEMBL8555198 0.76 CHEK1 (0.42)
SCHEMBL8557245 0.75 GRIN2D (0.41) GRIA1GRIA2GRIA3GRIA4GRIN2D
SCHEMBL8555427 0.74 KDM4E (0.42) GRIA1GRIA2GRIA3GRIA4GRIN2D
SCHEMBL8559627 0.73 GRIN2D (0.39) GRIA1GRIA2GRIA3GRIA4GRIN2D
SCHEMBL8555088 0.71 GRIN2D (0.37) GRIA1GRIA2GRIA3GRIA4GRIN2D
SCHEMBL8552484 0.71 CHEK1 (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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0691970-B1 IMIDAZOLOQUINOXALINONE DERIVATIVES AS EAA ANTAGONISTS BASF AG (DE) 1998-11-11 EP claimed