SCHEMBL15089243

SCHEMBL15089243

c1ccc(-c2ccc(N3c4cc5c(cc4-c4cccc6cccc3c46)c3cc(-c4ccccn4)ccc3n5-c3ccccn3)nc2)nc1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 4/20 0.40
ALDH1A1 P00352 2/20 0.40
GAA P10253 1/20 0.40
MAPT P10636 2/20 0.37
CNR2 P34972 1/20 0.36
IRAK4 Q9NWZ3 3/20 0.35
CASP1 P29466 2/20 0.34
CASP7 P55210 1/20 0.34
PDE6D O43924 1/20 0.34
MEN1 O00255 3/20 0.33
KMT2A Q03164 3/20 0.33
HPGD P15428 2/20 0.33
LMNA P02545 1/20 0.33
HTR1A P08908 1/20 0.33
DRD2 P14416 1/20 0.33
HTR2A P28223 1/20 0.33
HTR7 P34969 1/20 0.33
HTR6 P50406 1/20 0.33
MAPK14 Q16539 1/20 0.32
TSHR P16473 1/20 0.32

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
SCHEMBL15089060 0.98 MAPT (0.39) KDM4EALDH1A1GAAMAPTCNR2
SCHEMBL15089160 0.96 PDE6D (0.39) KDM4EALDH1A1GAAMAPTCNR2
SCHEMBL15089135 0.94 KDM4E (0.40) KDM4EALDH1A1GAAMAPTCNR2
SCHEMBL15089267 0.94 PDE6D (0.38) KDM4EALDH1A1GAAMAPTCNR2
SCHEMBL15089240 0.93 MAPT (0.36) KDM4EALDH1A1GAAMAPTCNR2
SCHEMBL15088922 0.93 MAPT (0.39) KDM4EALDH1A1GAAMAPTCNR2
SCHEMBL15089072 0.91 MAPT (0.37) KDM4EALDH1A1GAAMAPTCNR2
SCHEMBL15089052 0.90 NPY5R (0.33) KDM4EALDH1A1GAAMAPTCNR2
SCHEMBL15089354 0.89 KDM4E (0.39) KDM4EALDH1A1GAAMAPTIRAK4
SCHEMBL15089172 0.89 CNR2 (0.39) KDM4EALDH1A1MAPTCNR2IRAK4

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