SCHEMBL15089328

SCHEMBL15089328

c1ccc(-c2cccc(N3c4cc5sc6ccccc6c5cc4-c4cccc5cccc3c45)c2)cc1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDE6D O43924 1/20 0.43
ALDH1A1 P00352 3/20 0.35
FAAH O00519 1/20 0.35
HSP90AA1 P07900 1/20 0.35
PKM P14618 1/20 0.35
HTT P42858 1/20 0.35
ATM Q13315 1/20 0.35
MGLL Q99685 1/20 0.35
F9 P00740 1/20 0.33
SLC9A1 P19634 1/20 0.32
POLB P06746 2/20 0.31
KDM4E B2RXH2 1/20 0.31
MEN1 O00255 1/20 0.31
DUSP3 P51452 1/20 0.31
PTPN5 P54829 1/20 0.31
KMT2A Q03164 1/20 0.31
PTPN11 Q06124 1/20 0.31
CTDSP1 Q9GZU7 1/20 0.31
GPR3 P46089 1/20 0.31
MAPT P10636 2/20 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
SCHEMBL15089336 0.92 PDE6D (0.52) PDE6DALDH1A1F9SLC9A1POLB
SCHEMBL15088867 0.92 PDE6D (0.41) PDE6DALDH1A1HTTATMF9
SCHEMBL15089381 0.89 PDE6D (0.36) PDE6DATMKDM4EL3MBTL1
SCHEMBL15089329 0.85 KDM4E (0.33) PDE6DATMKDM4EL3MBTL1
SCHEMBL15089404 0.84 PDE6D (0.37) PDE6DALDH1A1F9POLBKDM4E
SCHEMBL15089014 0.83 PDE6D (0.37) PDE6DALDH1A1ATMF9SLC9A1
SCHEMBL15089325 0.83 ALDH1A1 (0.41) PDE6DALDH1A1HTTPOLBKDM4E
SCHEMBL15089414 0.83 MAPT (0.44) PDE6DALDH1A1HTTATMKDM4E
SCHEMBL15089184 0.83 PDE6D (0.36) PDE6DALDH1A1F9SLC9A1KDM4E
SCHEMBL15089183 0.82 PDE6D (0.37) PDE6DALDH1A1F9POLBKDM4E

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