SCHEMBL15089267

SCHEMBL15089267

c1ccc(-c2ccc3c(c2)c2cc4c(cc2n3-c2ccc(-c3ccccn3)cn2)N(c2ccc(-c3ccccn3)cn2)c2cccc3cccc-4c23)cc1

nearest known ligand 0.38

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
PDE6D O43924 1/20 0.38
MAPT P10636 1/20 0.37
CNR2 P34972 1/20 0.35
KDM4E B2RXH2 2/20 0.35
ALDH1A1 P00352 1/20 0.35
GAA P10253 1/20 0.35
MEN1 O00255 1/20 0.32
LMNA P02545 1/20 0.32
HPGD P15428 1/20 0.32
KMT2A Q03164 1/20 0.32
KDR P35968 1/20 0.32
MAPK14 Q16539 1/20 0.32
IRAK4 Q9NWZ3 1/20 0.31
MET P08581 1/20 0.31
CASP1 P29466 1/20 0.30
CASP7 P55210 1/20 0.30
CTSD P07339 1/20 0.30
PARP1 P09874 1/20 0.30
DHODH Q02127 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
SCHEMBL15089160 0.98 PDE6D (0.39) PDE6DMAPTCNR2KDM4EALDH1A1
SCHEMBL15089060 0.95 MAPT (0.39) PDE6DMAPTCNR2KDM4EALDH1A1
SCHEMBL15089243 0.94 KDM4E (0.40) PDE6DMAPTCNR2KDM4EALDH1A1
SCHEMBL15088922 0.92 MAPT (0.39) PDE6DMAPTCNR2KDM4EALDH1A1
SCHEMBL15088822 0.91 CNR2 (0.38) MAPTCNR2MEN1LMNAHPGD
SCHEMBL15089072 0.91 MAPT (0.37) PDE6DMAPTCNR2KDM4EALDH1A1
SCHEMBL15089135 0.90 KDM4E (0.40) PDE6DMAPTCNR2KDM4EALDH1A1
SCHEMBL15089293 0.90 PDE6D (0.42) PDE6DMAPTKDM4EALDH1A1GAA
SCHEMBL15089240 0.89 MAPT (0.36) PDE6DMAPTCNR2KDM4EALDH1A1
SCHEMBL15089157 0.89 PDE6D (0.36) PDE6DMAPTKDM4EALDH1A1GAA

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