SCHEMBL16613707

SCHEMBL16613707

c1ccc(-c2ccc(-c3ccc4c(c3)c3ccc5c(ccn5-c5ccccc5)c3n4-c3ccc(-c4ccccc4)cc3)cc2)cc1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAOB P27338 1/20 0.36
KDM4E B2RXH2 1/20 0.34
ATM Q13315 1/20 0.34
L3MBTL1 Q9Y468 1/20 0.34
NR3C1 P04150 1/20 0.34
METTL3 Q86U44 2/20 0.34
METTL14 Q9HCE5 2/20 0.34
HTR7 P34969 1/20 0.33
KDR P35968 1/20 0.33
LIMK1 P53667 1/20 0.32
KHK P50053 1/20 0.32
AVPR1A P37288 1/20 0.31
MCHR1 Q99705 1/20 0.31
HDAC3 O15379 1/20 0.31
HDAC4 P56524 1/20 0.31
HDAC1 Q13547 1/20 0.31
HDAC7 Q8WUI4 1/20 0.31
HDAC2 Q92769 1/20 0.31
HDAC10 Q969S8 1/20 0.31
HDAC11 Q96DB2 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
SCHEMBL16613826 1.00 MAOB (0.36) MAOBKDM4EATML3MBTL1NR3C1
SCHEMBL15632014 1.00 MAOB (0.36) MAOBKDM4EATML3MBTL1NR3C1
SCHEMBL16613847 0.99 MAOB (0.37) MAOBKDM4EATML3MBTL1NR3C1
SCHEMBL16613794 0.97 MAOB (0.35) MAOBKDM4EATML3MBTL1NR3C1
SCHEMBL16613708 0.97 MAOB (0.35) MAOBKDM4EATML3MBTL1NR3C1
SCHEMBL16613835 0.97 MAOB (0.35) MAOBKDM4EATML3MBTL1NR3C1
SCHEMBL16613827 0.97 MAOB (0.35) MAOBKDM4EATML3MBTL1NR3C1
SCHEMBL16613777 0.96 MAOB (0.36) MAOBKDM4EATML3MBTL1NR3C1
SCHEMBL16613860 0.96 MAOB (0.36) MAOBKDM4EATML3MBTL1NR3C1
SCHEMBL17015232 0.95 L3MBTL1 (0.44) MAOBKDM4EATML3MBTL1NR3C1

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-2015046981-A2 ORGANIC COMPOUND AND ORGANIC ELECTROLUMINESCENT ELEMENT COMPRISING SAME 주식회사 두산 2015-04-02 WO disclosed