SCHEMBL8612872

SCHEMBL8612872

CCOC(=O)Cn1c(=O)c(=O)[nH]c2cc(C(F)(F)F)c(-n3ccc(C=NO)c3)cc21

nearest known ligand 0.75

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
GRIA1 P42261 16/20 0.75
GRIA2 P42262 16/20 0.75
GRIA3 P42263 16/20 0.75
GRIA4 P48058 16/20 0.75
GRIK1 P39086 9/20 0.57
GRIK2 Q13002 9/20 0.57
GRIK3 Q13003 9/20 0.57
GRIK4 Q16099 9/20 0.57
GRIK5 Q16478 9/20 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
SCHEMBL8612870 1.00 GRIA1 (0.75) GRIA1GRIA2GRIA3GRIA4GRIK1
SCHEMBL7668608 0.91 GRIA1 (0.78) GRIA1GRIA2GRIA3GRIA4GRIK1
SCHEMBL8609934 0.89 GRIA1 (0.75) GRIA1GRIA2GRIA3GRIA4GRIK1
SCHEMBL8609929 0.89 GRIA1 (0.75) GRIA1GRIA2GRIA3GRIA4GRIK1
SCHEMBL8609954 0.87 GRIA1 (0.78) GRIA1GRIA2GRIA3GRIA4GRIK1
SCHEMBL8683231 0.87 GRIA1 (0.85) GRIA1GRIA2GRIA3GRIA4GRIK1
SCHEMBL8683228 0.87 GRIA1 (0.85) GRIA1GRIA2GRIA3GRIA4GRIK1
SCHEMBL24312933 0.86 GRIA1 (0.77) GRIA1GRIA2GRIA3GRIA4GRIK1
SCHEMBL8609391 0.84 GRIA1 (0.80) GRIA1GRIA2GRIA3GRIA4GRIK1
SCHEMBL7973994 0.83 GRIA1 (0.74) 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 4 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
EP-0572852-B1 Quinoxalin-2,3(1H,4H)-diones used as medicine BASF AG (DE) 1998-10-21 EP disclosed
US-5714489-A 2,3(1H,4H)quinoxalinedione BASF AKTIENGESELLSCHAFT (DE) 1998-02-03 US disclosed
EP-0572852-A1 Quinoxalin-2,3(1H,4H)-diones used as medicine BASF Aktiengesellschaft (DE) 1993-12-08 EP disclosed