SCHEMBL9038799

SCHEMBL9038799

O=c1[nH]c2cc(F)c(F)cc2n2cnnc12

nearest known ligand 0.68

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
GRIA1 P42261 3/20 0.68
GRIA2 P42262 3/20 0.68
GRIA3 P42263 3/20 0.68
GRIA4 P48058 3/20 0.68
GRIN2D O15399 2/20 0.68
GRIN3B O60391 2/20 0.68
GRIN1 Q05586 2/20 0.68
GRIN2A Q12879 2/20 0.68
GRIN2B Q13224 2/20 0.68
GRIN2C Q14957 2/20 0.68
GRIN3A Q8TCU5 2/20 0.68
POLB P06746 2/20 0.59
DAO P14920 1/20 0.42

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
SCHEMBL9037767 0.81 GRIA1 (1.00) GRIA1GRIA2GRIA3GRIA4GRIN2D
SCHEMBL9037104 0.77 GRIA1 (0.62) GRIA1GRIA2GRIA3GRIA4GRIN2D
SCHEMBL3493681 0.75 GRIA1 (0.68) GRIA1GRIA2GRIA3GRIA4GRIN2D
SCHEMBL9038869 0.75 POLB (0.58) GRIA1GRIA2GRIA3GRIA4GRIN2D
SCHEMBL1599006 0.74 POLB (1.00) GRIA1GRIA2GRIA3GRIA4GRIN2D
SCHEMBL30273081 0.74 POLB (1.00) GRIA1GRIA2GRIA3GRIA4GRIN2D
SCHEMBL123451 0.64 KDM4E (0.58) GRIA1GRIA2GRIA3GRIA4GRIN2D
SCHEMBL7983698 0.63 TP53 (0.35) GRIA1GRIA2GRIA3GRIA4GRIN2D
SCHEMBL16824184 0.63 KDM4E (0.46) GRIA1GRIA2GRIA3GRIA4GRIN2D
SCHEMBL31026839 0.63 TP53 (0.35) 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-0518530-B1 Improvements in or relating to excitatory amino acid receptor antagonists LILLY CO ELI (US) 1996-10-09 EP disclosed
US-5196421-A Treatment of neurological disorders ELI LILLY AND COMPANY (US) 1993-03-23 US disclosed
US-5153196-A Administering for reduction of neurotransmission in nervous system disorders ELI LILLY AND COMPANY (US) 1992-10-06 US disclosed