SCHEMBL8190067

SCHEMBL8190067

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

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 3/20 0.49
MAPT P10636 5/20 0.43
L3MBTL1 Q9Y468 1/20 0.41
GLA P06280 1/20 0.40
KDM4E B2RXH2 2/20 0.39
GRIK1 P39086 1/20 0.38
GRIA1 P42261 1/20 0.38
GRIA2 P42262 1/20 0.38
GRIA3 P42263 1/20 0.38
GRIA4 P48058 1/20 0.38
GRIK2 Q13002 1/20 0.38
GRIK3 Q13003 1/20 0.38
GRIK4 Q16099 1/20 0.38
GRIK5 Q16478 1/20 0.38
SLC22A6 Q4U2R8 1/20 0.36
SLC22A8 Q8TCC7 1/20 0.36
ALDH1A1 P00352 3/20 0.36
NPC1 O15118 1/20 0.36
PKM P14618 1/20 0.36
CRHBP P24387 1/20 0.36

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 0.90 LMNA (0.51) LMNAMAPTL3MBTL1GLAKDM4E
SCHEMBL8191460 0.88 LMNA (0.49) LMNAMAPTL3MBTL1GLAKDM4E
SCHEMBL8192774 0.88 LMNA (0.49) LMNAMAPTL3MBTL1GLAKDM4E
SCHEMBL8191893 0.87 LMNA (0.48) LMNAMAPTL3MBTL1GLAKDM4E
SCHEMBL7811079 0.86 GLA (0.53) LMNAMAPTL3MBTL1GLAKDM4E
SCHEMBL8196364 0.86 LMNA (0.47) LMNAMAPTGLAKDM4EGRIK1
SCHEMBL27369574 0.85 LMNA (0.46) LMNAMAPTL3MBTL1GLAKDM4E
SCHEMBL7814569 0.82 LMNA (0.51) LMNAMAPTL3MBTL1GLAKDM4E
SCHEMBL7807447 0.81 LMNA (0.45) LMNAMAPTL3MBTL1GLAPKM
SCHEMBL8189990 0.81 LMNA (0.55) LMNAMAPTL3MBTL1KDM4EALDH1A1

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