SCHEMBL7811079

SCHEMBL7811079

CCOC(=O)CNc1cc(-n2ccnc2)c(C#N)cc1[N+](=O)[O-]

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GLA P06280 1/20 0.53
LMNA P02545 3/20 0.47
MAPT P10636 4/20 0.44
KDM4E B2RXH2 2/20 0.37
GRIK1 P39086 1/20 0.36
GRIA1 P42261 1/20 0.36
GRIA2 P42262 1/20 0.36
GRIA3 P42263 1/20 0.36
GRIA4 P48058 1/20 0.36
GRIK2 Q13002 1/20 0.36
GRIK3 Q13003 1/20 0.36
GRIK4 Q16099 1/20 0.36
GRIK5 Q16478 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
SLC22A6 Q4U2R8 1/20 0.35
SLC22A8 Q8TCC7 1/20 0.35
ALDH1A1 P00352 2/20 0.35
NPC1 O15118 1/20 0.35
PKM P14618 1/20 0.35
CRHBP P24387 1/20 0.35

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
SCHEMBL8190261 0.88 LMNA (0.51) GLALMNAMAPTKDM4EGRIK1
SCHEMBL8191460 0.86 LMNA (0.49) GLALMNAMAPTKDM4EGRIK1
SCHEMBL8192774 0.86 LMNA (0.49) GLALMNAMAPTKDM4EGRIK1
SCHEMBL8190067 0.86 LMNA (0.49) GLALMNAMAPTKDM4EGRIK1
SCHEMBL8191893 0.85 LMNA (0.48) GLALMNAMAPTKDM4EGRIK1
SCHEMBL8196364 0.83 LMNA (0.47) GLALMNAMAPTKDM4EGRIK1
SCHEMBL27369574 0.83 LMNA (0.46) GLALMNAMAPTKDM4EGRIK1
SCHEMBL7814569 0.80 LMNA (0.51) GLALMNAMAPTKDM4EL3MBTL1
SCHEMBL7807447 0.79 LMNA (0.45) GLALMNAMAPTL3MBTL1PKM
SCHEMBL8189990 0.78 LMNA (0.55) LMNAMAPTKDM4EL3MBTL1ALDH1A1

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-0784054-B1 1,2,3,4-TETRAHYDROQUINOXALINEDIONE DERIVATIVES AND USE AS GLUTAMATE RECEPTOR ANTAGONISTS YAMANOUCHI PHARMA CO LTD (JP) 2001-11-28 EP disclosed
US-6096743-A 1,2,3,4-tetrahydroquinoxalinedione derivative YAMANOUCHI PHARMACEUTICALS CO., LTD. (JP) 2000-08-01 US disclosed
EP-0784054-A1 1,2,3,4-TETRAHYDROQUINOXALINEDIONE DERIVATIVE YAMANOUCHI PHARMACEUTICAL CO. LTD. (JP) 1997-07-16 EP disclosed