SCHEMBL15089161

SCHEMBL15089161

c1ccc(-c2ccc3c(c2)c2cc4c(cc2n3-c2ccccn2)N(c2cccc(-n3c5ccccc5c5ccccc53)n2)c2cccc3cccc-4c23)cc1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDE6D O43924 1/20 0.39
KDM4E B2RXH2 4/20 0.36
ALDH1A1 P00352 4/20 0.36
GAA P10253 1/20 0.36
MEN1 O00255 3/20 0.35
KMT2A Q03164 3/20 0.35
LMNA P02545 2/20 0.35
HPGD P15428 1/20 0.35
MAPT P10636 2/20 0.33
HTT P42858 2/20 0.33
MAPK1 P28482 1/20 0.33
UHRF1 Q96T88 1/20 0.33
CASP1 P29466 2/20 0.33
CASP7 P55210 1/20 0.33
HTR1A P08908 1/20 0.31
DRD2 P14416 1/20 0.31
HTR2A P28223 1/20 0.31
HTR7 P34969 1/20 0.31
HTR6 P50406 1/20 0.31
IRAK4 Q9NWZ3 1/20 0.31

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
SCHEMBL15089287 0.94 PDE6D (0.43) PDE6DMEN1KMT2A
SCHEMBL15089293 0.93 PDE6D (0.42) PDE6DKDM4EALDH1A1GAAMEN1
SCHEMBL15089253 0.93 KDM4E (0.36) PDE6DKDM4EALDH1A1GAAMEN1
SCHEMBL15089153 0.92 KDM4E (0.41) PDE6DKDM4EALDH1A1GAAMEN1
SCHEMBL15089145 0.91 PDE6D (0.37) PDE6DKDM4EALDH1A1GAAMEN1
SCHEMBL15089061 0.90 NPY5R (0.35) PDE6DKDM4EALDH1A1GAAMEN1
SCHEMBL15089162 0.90 PDE6D (0.39) PDE6DKDM4EALDH1A1GAAMEN1
SCHEMBL15088906 0.88 KDM4E (0.46) PDE6DKDM4EALDH1A1GAAMEN1
SCHEMBL15089136 0.88 PDE6D (0.43) PDE6DKDM4EALDH1A1GAAMEN1
SCHEMBL15089077 0.88 KDM4E (0.40) PDE6DKDM4EALDH1A1GAAMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2013100497-A1 ORGANIC LIGHT-EMITTING COMPOUND AND ORGANIC ELECTROLUMINESCENT DEVICE USING SAME 주식회사 두산 (KR) 2013-07-04 WO disclosed