SCHEMBL8190016

SCHEMBL8190016

CC(C)(C)OC(=O)CNc1cc(-n2ccnc2)c(C(F)(F)F)cc1[N+](=O)[O-]

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.41
SERPINE1 P05121 1/20 0.38
ALDH1A1 P00352 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
MEN1 O00255 3/20 0.35
KMT2A Q03164 3/20 0.35
PKM P14618 1/20 0.35
STAT3 P40763 1/20 0.35
SLC22A6 Q4U2R8 1/20 0.35
SLC22A8 Q8TCC7 1/20 0.35
L3MBTL1 Q9Y468 1/20 0.35
LMNA P02545 1/20 0.34

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
SCHEMBL8194623 0.87 MAPT (0.43) MAPTGRIK1GRIA1GRIA2GRIA3
SCHEMBL8190346 0.83 LMNA (0.45) MAPTALDH1A1GRIK1GRIA1GRIA2
SCHEMBL8781503 0.81 LMNA (0.41) MAPTALDH1A1GRIK1GRIA1GRIA2
SCHEMBL7351746 0.80 SERPINE1 (0.55) MAPTSERPINE1ALDH1A1GRIK1GRIA1
SCHEMBL8201947 0.79 ALDH1A1 (0.45) MAPTSERPINE1ALDH1A1GRIK1GRIA1
SCHEMBL8194643 0.79 MEN1 (0.42) SERPINE1ALDH1A1MEN1KMT2APKM
SCHEMBL8144201 0.77 GRIK1 (0.41) MAPTALDH1A1GRIK1GRIA1GRIA2
SCHEMBL8192774 0.76 LMNA (0.49) MAPTALDH1A1GRIK1GRIA1GRIA2
SCHEMBL8190261 0.76 LMNA (0.51) MAPTALDH1A1GRIK1GRIA1GRIA2
SCHEMBL8191460 0.74 LMNA (0.49) MAPTALDH1A1GRIK1GRIA1GRIA2

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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