SCHEMBL8196364

SCHEMBL8196364

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

nearest known ligand 0.47

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.47
MAPT P10636 2/20 0.41
GRIK1 P39086 1/20 0.39
GRIA1 P42261 1/20 0.39
GRIA2 P42262 1/20 0.39
GRIA3 P42263 1/20 0.39
GRIA4 P48058 1/20 0.39
GRIK2 Q13002 1/20 0.39
GRIK3 Q13003 1/20 0.39
GRIK4 Q16099 1/20 0.39
GRIK5 Q16478 1/20 0.39
MEN1 O00255 1/20 0.38
KMT2A Q03164 1/20 0.38
GLA P06280 1/20 0.38
KDM4E B2RXH2 1/20 0.37
SLC22A6 Q4U2R8 1/20 0.37
SLC22A8 Q8TCC7 1/20 0.37

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) LMNAMAPTGRIK1GRIA1GRIA2
SCHEMBL8191460 0.86 LMNA (0.49) LMNAMAPTGRIK1GRIA1GRIA2
SCHEMBL8190067 0.86 LMNA (0.49) LMNAMAPTGRIK1GRIA1GRIA2
SCHEMBL8192774 0.86 LMNA (0.49) LMNAMAPTGRIK1GRIA1GRIA2
SCHEMBL8191893 0.85 LMNA (0.48) LMNAMAPTGRIK1GRIA1GRIA2
SCHEMBL7811079 0.83 GLA (0.53) LMNAMAPTGRIK1GRIA1GRIA2
SCHEMBL27369574 0.83 LMNA (0.46) LMNAMAPTGRIK1GRIA1GRIA2
SCHEMBL7814569 0.80 LMNA (0.51) LMNAMAPTMEN1KMT2AGLA
SCHEMBL8190346 0.79 LMNA (0.45) LMNAMAPTGRIK1GRIA1GRIA2
SCHEMBL7807447 0.79 LMNA (0.45) LMNAMAPTMEN1KMT2AGLA

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
CN-1067387-C 1,2,3,4-tetrahydroquinoxalindione derivative YAMANOUCHI PHARMA CO LTD (JP) 2001-06-20 CN disclosed
US-6096743-A 1,2,3,4-tetrahydroquinoxalinedione derivative YAMANOUCHI PHARMACEUTICALS CO., LTD. (JP) 2000-08-01 US disclosed
CN-1168670-A 1,2,3,4-tetrahydroquinoxalindione derivative YAMANOUCHI PHARMA CO LTD (JP) 1997-12-24 CN disclosed
EP-0784054-A1 1,2,3,4-TETRAHYDROQUINOXALINEDIONE DERIVATIVE YAMANOUCHI PHARMACEUTICAL CO. LTD. (JP) 1997-07-16 EP disclosed