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SCHEMBL8799682

SCHEMBL8799682

Cc1c(OC(=O)O)nc2c(=O)[nH]c3cc(C(F)(F)F)c(-n4cncn4)cc3n12

nearest known ligand 0.44

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ GRIA1 P42261 1/20 0.38
▸ GRIA2 P42262 1/20 0.38
▸ GRIA3 P42263 1/20 0.38
▸ GRIA4 P48058 1/20 0.38

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
SCHEMBL8034214 0.86 GRIA1 (0.39) GRIA1GRIA2GRIA3GRIA4
SCHEMBL9056961 0.85 GRIA1 (0.44) GRIA1GRIA2GRIA3GRIA4
SCHEMBL8799738 0.84 GRIA1 (0.52) GRIA1GRIA2GRIA3GRIA4
SCHEMBL8034435 0.82 CHEK1 (0.51) GRIA1GRIA2GRIA3GRIA4
SCHEMBL8556101 0.82 GRIN2D (0.39) GRIA1GRIA2GRIA3GRIA4
SCHEMBL9057402 0.82 PARP1 (0.38) GRIA1GRIA2GRIA3GRIA4
SCHEMBL8559119 0.79 CHEK1 (0.46) —
SCHEMBL8557905 0.76 GRIN2D (0.43) GRIA1GRIA2GRIA3GRIA4
SCHEMBL8557418 0.76 PDE5A (0.49) —
SCHEMBL8799619 0.74 GRIA1 (0.52) GRIA1GRIA2GRIA3GRIA4

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-0783506-A1 NEW HETEROCYCLIC SUBSTITUTED IMIDAZOLOQUINOXALINONES, THEIR PREPARATION AND THEIR USE BASF AKTIENGESELLSCHAFT (DE) 1997-07-16 — — EP disclosed
WO-1996010572-A1 NEW HETEROCYCLIC SUBSTITUTED IMIDAZOLOQUINOXALINONES, THEIR PREPARATION AND THEIR USE BASF AKTIENGESELLSCHAFT (DE) 1996-04-11 — — WO disclosed