SCHEMBL8611573

SCHEMBL8611573

O=C(Cn1c(=O)c(=O)[nH]c2cc([N+](=O)[O-])c(-n3cccc3)cc21)NCc1ccccc1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
GRIK1 P39086 8/20 0.72
GRIK2 Q13002 8/20 0.72
GRIK5 Q16478 8/20 0.72
GRIA1 P42261 7/20 0.72
GRIA2 P42262 7/20 0.72
GRIA3 P42263 7/20 0.72
GRIA4 P48058 7/20 0.72
GRIK3 Q13003 7/20 0.72
GRIK4 Q16099 5/20 0.72
SLC22A6 Q4U2R8 1/20 0.57
SLC22A8 Q8TCC7 1/20 0.57

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
SCHEMBL8610328 0.87 GRIK1 (0.75) GRIK1GRIK2GRIK5GRIA1GRIA2
SCHEMBL8609541 0.87 GRIK1 (0.74) GRIK1GRIK2GRIK5GRIA1GRIA2
SCHEMBL8611517 0.84 GRIK1 (1.00) GRIK1GRIK2GRIK5GRIA1GRIA2
SCHEMBL8612886 0.83 GRIA1 (0.72) GRIK1GRIK2GRIK5GRIA1GRIA2
SCHEMBL7668821 0.79 GRIA1 (0.79) GRIK1GRIK2GRIK5GRIA1GRIA2
SCHEMBL8609604 0.79 GRIK1 (0.78) GRIK1GRIK2GRIK5GRIA1GRIA2
SCHEMBL8673956 0.78 GRIA1 (1.00) GRIK1GRIK2GRIK5GRIA1GRIA2
SCHEMBL8610087 0.77 GRIK1 (0.82) GRIK1GRIK2GRIK5GRIA1GRIA2
SCHEMBL7668356 0.77 GRIA1 (0.75) GRIK1GRIK2GRIK5GRIA1GRIA2
SCHEMBL7662232 0.76 GRIA1 (0.87) GRIK1GRIK2GRIK5GRIA1GRIA2

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