SCHEMBL15089183

SCHEMBL15089183

c1ccc(-c2cc(-c3ccccc3)nc(N3c4cc5sc6ccccc6c5cc4-c4cccc5cccc3c45)c2)cc1

nearest known ligand 0.37

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
PDE6D O43924 1/20 0.37
ALDH1A1 P00352 2/20 0.31
MAPT P10636 2/20 0.31
KDM4E B2RXH2 1/20 0.31
HPGD P15428 1/20 0.31
POLB P06746 1/20 0.30
TDP1 Q9NUW8 1/20 0.30
L3MBTL1 Q9Y468 1/20 0.30
F9 P00740 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
SCHEMBL15089404 0.88 PDE6D (0.37) PDE6DALDH1A1MAPTKDM4EHPGD
SCHEMBL15089184 0.87 PDE6D (0.36) PDE6DALDH1A1MAPTKDM4EHPGD
SCHEMBL15089336 0.83 PDE6D (0.52) PDE6DALDH1A1MAPTHPGDPOLB
SCHEMBL15089328 0.82 PDE6D (0.43) PDE6DALDH1A1MAPTKDM4EHPGD
SCHEMBL15089014 0.81 PDE6D (0.37) PDE6DALDH1A1MAPTKDM4EHPGD
SCHEMBL15089377 0.81 PDE6D (0.34) PDE6D
SCHEMBL15088891 0.81 PDE6D (0.37) PDE6DALDH1A1MAPTKDM4EHPGD
SCHEMBL15088867 0.81 PDE6D (0.41) PDE6DALDH1A1MAPTKDM4EHPGD
SCHEMBL15089333 0.80 KDM4E (0.45) PDE6DALDH1A1MAPTKDM4EHPGD
SCHEMBL15089152 0.79 PDE6D (0.38) PDE6DALDH1A1MAPTKDM4EHPGD

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