SCHEMBL15088959

SCHEMBL15088959

c1ccc(-c2cccc(-n3c4ccccc4c4c5c(ccc43)-c3ccc(-c4ccccc4)c4cccc(c34)N5c3ccccc3)c2)cc1

nearest known ligand 0.34

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
ATM Q13315 2/20 0.34
KDM4E B2RXH2 1/20 0.34
L3MBTL1 Q9Y468 1/20 0.34
PDE6D O43924 1/20 0.33
FAAH O00519 1/20 0.32
ALDH1A1 P00352 1/20 0.32
HSP90AA1 P07900 1/20 0.32
PKM P14618 1/20 0.32
HTT P42858 1/20 0.32
MGLL Q99685 1/20 0.32
MAPK14 Q16539 1/20 0.32
PDE10A Q9Y233 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
SCHEMBL15088950 0.94 KDM4E (0.37) ATMKDM4EL3MBTL1PDE6D
SCHEMBL15088974 0.93 KDM4E (0.35) ATMKDM4EL3MBTL1PDE6DMAPK14
SCHEMBL15088964 0.91 PDE6D (0.35) ATMKDM4EL3MBTL1PDE6D
SCHEMBL15088949 0.91 L3MBTL1 (0.42) ATMKDM4EL3MBTL1PDE6DALDH1A1
SCHEMBL15088945 0.90 PDE6D (0.33) ATMPDE6DFAAHALDH1A1HSP90AA1
SCHEMBL15088939 0.90 PDE6D (0.37) ATMKDM4EL3MBTL1PDE6D
SCHEMBL15089276 0.90 PDE6D (0.44) ATMKDM4EL3MBTL1PDE6DFAAH
SCHEMBL15088972 0.86 KDM4E (0.32) KDM4EALDH1A1HTT
SCHEMBL15089068 0.86 PDE6D (0.32) PDE6D
SCHEMBL15088944 0.86 PIK3CA (0.37) ATMKDM4EL3MBTL1PDE6DHSP90AA1

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