SCHEMBL15089111

SCHEMBL15089111

c1ccc(-n2c3ccccc3c3cc4c(cc32)N(c2cc(-c3ccccn3)ccn2)c2cccc3cccc-4c23)cc1

nearest known ligand 0.33

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 3/20 0.33
ALDH1A1 P00352 1/20 0.33
GAA P10253 1/20 0.33
ATM Q13315 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
CASP1 P29466 1/20 0.32
CASP7 P55210 1/20 0.32
COMT P21964 1/20 0.32
MAPK14 Q16539 1/20 0.32
MCL1 Q07820 3/20 0.32
PDE6D O43924 1/20 0.32
MEN1 O00255 1/20 0.31
LMNA P02545 1/20 0.31
HPGD P15428 1/20 0.31
KMT2A Q03164 1/20 0.31
HTR1A P08908 1/20 0.31
HTR7 P34969 1/20 0.31
ACVR1B P36896 2/20 0.31
TGFBR1 P36897 2/20 0.31
DHFR P00374 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
SCHEMBL15088910 0.94 KDM4E (0.35) KDM4EALDH1A1GAACASP1CASP7
SCHEMBL15089357 0.92 PDE6D (0.36) KDM4EALDH1A1GAACASP1CASP7
SCHEMBL15089139 0.91 PDE6D (0.38) KDM4EALDH1A1GAAATML3MBTL1
SCHEMBL15089241 0.91 PDE6D (0.33) KDM4EALDH1A1GAAATML3MBTL1
SCHEMBL15089065 0.90 PDE6D (0.34) KDM4EALDH1A1GAAATML3MBTL1
SCHEMBL15089354 0.89 KDM4E (0.39) KDM4EALDH1A1GAACASP1CASP7
SCHEMBL15089129 0.89 PDE6D (0.34) KDM4EALDH1A1GAAATML3MBTL1
SCHEMBL15089115 0.89 KDM4E (0.43) KDM4EALDH1A1GAAATML3MBTL1
SCHEMBL15089058 0.88 KDM4E (0.35) KDM4EALDH1A1GAACASP1CASP7
SCHEMBL15089026 0.86 PDE6D (0.35) KDM4EALDH1A1GAACASP1CASP7

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