SCHEMBL8610068

SCHEMBL8610068

O=C(O)Cn1c(=O)c(=O)[nH]c2cc([N+](=O)[O-])c(-n3ccc(/C=N/OCc4ccccc4)c3)cc21

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
GRIA1 P42261 10/20 1.00
GRIA2 P42262 10/20 1.00
GRIA3 P42263 10/20 1.00
GRIA4 P48058 10/20 1.00
GRIK1 P39086 10/20 0.65
GRIK2 Q13002 10/20 0.65
GRIK5 Q16478 8/20 0.65
GRIK3 Q13003 8/20 0.65
GRIK4 Q16099 3/20 0.64
SLC22A6 Q4U2R8 1/20 0.55
SLC22A8 Q8TCC7 1/20 0.55

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
SCHEMBL8610070 1.00 GRIA1 (1.00) GRIA1GRIA2GRIA3GRIA4GRIK1
SCHEMBL8611625 0.85 GRIA1 (1.00) GRIA1GRIA2GRIA3GRIA4GRIK1
SCHEMBL8611628 0.85 GRIA1 (1.00) GRIA1GRIA2GRIA3GRIA4GRIK1
SCHEMBL8681277 0.83 GRIA1 (0.76) GRIA1GRIA2GRIA3GRIA4GRIK1
SCHEMBL8611517 0.80 GRIK1 (1.00) GRIA1GRIA2GRIA3GRIA4GRIK1
SCHEMBL8672087 0.79 GRIK1 (1.00) GRIA1GRIA2GRIA3GRIA4GRIK1
SCHEMBL8672098 0.78 GRIA1 (1.00) GRIA1GRIA2GRIA3GRIA4GRIK1
SCHEMBL2053498 0.78 GRIA1 (1.00) GRIA1GRIA2GRIA3GRIA4GRIK1
SCHEMBL8683231 0.78 GRIA1 (0.85) GRIA1GRIA2GRIA3GRIA4GRIK1
SCHEMBL8683228 0.78 GRIA1 (0.85) GRIA1GRIA2GRIA3GRIA4GRIK1

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
US-5852017-A 2,3(1H,4H)-quinoxalinediones BASF AKTIENGESELLSCHAFT (DE) 1998-12-22 US disclosed
US-5714489-A 2,3(1H,4H)quinoxalinedione BASF AKTIENGESELLSCHAFT (DE) 1998-02-03 US disclosed