SCHEMBL7807447

SCHEMBL7807447

CCOC(=O)CNc1cc(-n2ccnc2)c(OCc2ccccc2)cc1[N+](=O)[O-]

nearest known ligand 0.45

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.45
CTSV O60911 3/20 0.41
CTSL P07711 3/20 0.41
CYP19A1 P11511 3/20 0.40
MAPT P10636 3/20 0.38
PDE5A O76074 2/20 0.38
CYP11B1 P15538 2/20 0.37
CYP11B2 P19099 2/20 0.37
L3MBTL1 Q9Y468 2/20 0.37
PKM P14618 1/20 0.37
GLA P06280 1/20 0.37
MEN1 O00255 1/20 0.37
KMT2A Q03164 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
SCHEMBL8191893 0.86 LMNA (0.48) LMNACYP19A1MAPTCYP11B1CYP11B2
SCHEMBL8190261 0.83 LMNA (0.51) LMNAMAPTL3MBTL1PKMGLA
SCHEMBL8189990 0.83 LMNA (0.55) LMNAMAPTL3MBTL1PKMMEN1
SCHEMBL8781503 0.82 LMNA (0.41) LMNAMAPTL3MBTL1GLAKMT2A
SCHEMBL8190067 0.81 LMNA (0.49) LMNAMAPTL3MBTL1PKMGLA
SCHEMBL8191460 0.81 LMNA (0.49) LMNAMAPTL3MBTL1PKMGLA
SCHEMBL8192774 0.81 LMNA (0.49) LMNAMAPTL3MBTL1GLAMEN1
SCHEMBL7811510 0.80 LMNA (0.53) LMNACTSVCTSLCYP19A1MAPT
SCHEMBL7811079 0.79 GLA (0.53) LMNAMAPTL3MBTL1PKMGLA
SCHEMBL8196364 0.79 LMNA (0.47) LMNAMAPTGLAMEN1KMT2A

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 5 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
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