SCHEMBL13167243

SCHEMBL13167243

CNc1ccc(Nc2ccc(C)c3nc4c(nc23)OCO4)cc1

nearest known ligand 0.35

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
IDO1 P14902 2/20 0.35
MEN1 O00255 2/20 0.34
KMT2A Q03164 2/20 0.34
SMN1; SMN2 Q16637 1/20 0.33
KDM1A O60341 1/20 0.33
ADRA2A P08913 1/20 0.33
ADRA2B P18089 1/20 0.33
ADRA2C P18825 1/20 0.33
LMNA P02545 2/20 0.32
MAPT P10636 1/20 0.32
MAPK1 P28482 1/20 0.32
HTT P42858 1/20 0.32
TDP1 Q9NUW8 1/20 0.32
L3MBTL1 Q9Y468 1/20 0.32
ULK1 O75385 1/20 0.31
KDM4E B2RXH2 1/20 0.30

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
SCHEMBL13167244 0.91 SMN1; SMN2 (0.38) IDO1MEN1KMT2ASMN1; SMN2KDM1A
SCHEMBL13167240 0.78 NPC1 (0.38) IDO1MEN1KMT2ASMN1; SMN2KDM1A
SCHEMBL13167239 0.77 KDM1A (0.49) MEN1KMT2ASMN1; SMN2KDM1ALMNA
SCHEMBL13167232 0.75 KDM1A (0.46) IDO1MEN1KMT2ASMN1; SMN2KDM1A
SCHEMBL13167237 0.73 TP53 (0.43) IDO1MEN1KMT2ALMNAMAPT
SCHEMBL13167235 0.73 KDM1A (0.42) MEN1KMT2ASMN1; SMN2KDM1ALMNA
SCHEMBL13167234 0.70 LMNA (0.47) IDO1LMNAMAPTMAPK1TDP1
SCHEMBL13167229 0.70 GAA (0.43) MEN1KMT2ASMN1; SMN2LMNAMAPT
SCHEMBL13134347 0.66 MAPT (0.41) MEN1KMT2ASMN1; SMN2KDM1ALMNA
SCHEMBL23999258 0.60 CA12 (0.61) MEN1KMT2ASMN1; SMN2KDM1ALMNA

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-7799894-B2 copolymer of diaminobenzene with a diamine containing substituted quinoxaline ring (2,3-diphenyl-5-(4-aminophenyl)aminoquinoxaline, 2,3-di(4-methylphenyl)-5-(4-aminophenyl)aminoquinoxaline; Poly{2,3-di(2-thienyl)-5-(4-aminophenyl)aminoquinoxaline; polyaminequinoxalines YAMAGUCHI UNIVERSITY (JP) 2010-09-21 US disclosed
US-20070120112-A1 copolymer of diaminobenzene with a diamine containing substituted quinoxaline ring (2,3-diphenyl-5-(4-aminophenyl)aminoquinoxaline, 2,3-di(4-methylphenyl)-5-(4-aminophenyl)aminoquinoxaline; Poly{2,3-di(2-thienyl)-5-(4-aminophenyl)aminoquinoxaline; polyaminequinoxalines YAMAGUCHI UNIVERSITY (JP) 2007-05-31 US disclosed