SCHEMBL15089117

SCHEMBL15089117

c1ccc(-c2cc(-c3ccccc3)nc(N3c4cc5c(cc4-c4cccc6cccc3c46)c3ccccc3n5-c3ccccc3)n2)cc1

nearest known ligand 0.38

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
PDE6D O43924 1/20 0.38
KDM4E B2RXH2 1/20 0.38
ATM Q13315 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.38
RXFP1 Q9HBX9 1/20 0.31
MEN1 O00255 1/20 0.30
LMNA P02545 1/20 0.30
CYP1A2 P05177 1/20 0.30
MAPT P10636 1/20 0.30
CYP2C9 P11712 1/20 0.30
CYP2C19 P33261 1/20 0.30
MAPK10 P53779 1/20 0.30
KMT2A Q03164 1/20 0.30
SMN1; SMN2 Q16637 1/20 0.30
TDP1 Q9NUW8 1/20 0.30
PLAUR Q03405 1/20 0.30
MAPK14 Q16539 1/20 0.30
FLT3 P36888 1/20 0.30
BMX P51813 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
SCHEMBL15088951 0.94 PDE6D (0.37) PDE6DKDM4EL3MBTL1MEN1LMNA
SCHEMBL15089214 0.92 PDE6D (0.41) PDE6D
SCHEMBL15089118 0.91 PDE6D (0.39) PDE6DKDM4EATML3MBTL1RXFP1
SCHEMBL15089133 0.90 PDE6D (0.35) PDE6DKDM4EATML3MBTL1MAPT
SCHEMBL16884843 0.89 L3MBTL1 (0.41) KDM4EATML3MBTL1MEN1LMNA
SCHEMBL15089152 0.87 PDE6D (0.38) PDE6DKDM4EATML3MBTL1MAPT
SCHEMBL15089246 0.87 PDE6D (0.35) PDE6DMAPK14
SCHEMBL15089124 0.86 KDM4E (0.40) PDE6DKDM4EATML3MBTL1
SCHEMBL15088905 0.85 L3MBTL1 (0.46) PDE6DKDM4EATML3MBTL1MEN1
SCHEMBL15089295 0.85 PDE6D (0.40) PDE6DL3MBTL1MEN1LMNACYP1A2

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