SCHEMBL15089162

SCHEMBL15089162

c1ccc(-c2ccc3c(c2)c2cc4c(cc2n3-c2ccccn2)N(c2ccc(-n3c5ccccc5c5ccccc53)cn2)c2cccc3cccc-4c23)cc1

nearest known ligand 0.39

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
PDE6D O43924 1/20 0.39
KDM4E B2RXH2 3/20 0.35
ALDH1A1 P00352 2/20 0.35
GAA P10253 1/20 0.35
MEN1 O00255 2/20 0.34
LMNA P02545 2/20 0.34
KMT2A Q03164 2/20 0.34
HPGD P15428 1/20 0.34
MAPT P10636 1/20 0.31
MAPK1 P28482 1/20 0.31
HTT P42858 1/20 0.31
UHRF1 Q96T88 1/20 0.31
CASP1 P29466 1/20 0.30
CASP7 P55210 1/20 0.30
IRAK4 Q9NWZ3 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
SCHEMBL15089274 0.96 PDE6D (0.40) PDE6D
SCHEMBL15089359 0.93 KDM4E (0.35) PDE6DKDM4EALDH1A1GAAMEN1
SCHEMBL15089128 0.93 KDM4E (0.40) PDE6DKDM4EALDH1A1GAAMEN1
SCHEMBL15089052 0.91 NPY5R (0.33) PDE6DKDM4EALDH1A1GAAMAPT
SCHEMBL15089293 0.90 PDE6D (0.42) PDE6DKDM4EALDH1A1GAAMEN1
SCHEMBL15089161 0.90 PDE6D (0.39) PDE6DKDM4EALDH1A1GAAMEN1
SCHEMBL15089136 0.89 PDE6D (0.43) PDE6DKDM4EALDH1A1GAAMEN1
SCHEMBL15088900 0.89 PDE6D (0.34) PDE6DKDM4EALDH1A1GAA
SCHEMBL15089160 0.88 PDE6D (0.39) PDE6DKDM4EALDH1A1GAAMEN1
SCHEMBL15088823 0.88 PDE6D (0.30) PDE6D

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