SCHEMBL16613860

SCHEMBL16613860

c1ccc(-c2cc(-c3ccccc3)cc(-c3ccc4c(c3)c3ccc5c(ccn5-c5ccccc5)c3n4-c3ccccc3)c2)cc1

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAOB P27338 1/20 0.36
KDM4E B2RXH2 1/20 0.33
ATM Q13315 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
KDR P35968 1/20 0.32
LIMK1 P53667 1/20 0.32
METTL3 Q86U44 2/20 0.31
METTL14 Q9HCE5 2/20 0.31
NR3C1 P04150 1/20 0.31
AVPR1A P37288 1/20 0.31
HTR7 P34969 1/20 0.30
SRC P12931 1/20 0.30
PRKACA P17612 1/20 0.30
PRKACG P22612 1/20 0.30
PRKACB P22694 1/20 0.30
TSPO P30536 1/20 0.30
PLA2G4A P47712 1/20 0.30
OPRM1 P35372 1/20 0.30
OPRD1 P41143 1/20 0.30
KMT2A Q03164 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
SCHEMBL16613835 0.99 MAOB (0.35) MAOBKDM4EATML3MBTL1KDR
SCHEMBL16613794 0.99 MAOB (0.35) MAOBKDM4EATML3MBTL1KDR
SCHEMBL16613777 0.97 MAOB (0.36) MAOBKDM4EATML3MBTL1KDR
SCHEMBL16613847 0.97 MAOB (0.37) MAOBKDM4EATML3MBTL1KDR
SCHEMBL16613708 0.96 MAOB (0.35) MAOBKDM4EATML3MBTL1KDR
SCHEMBL16613840 0.96 MAOB (0.35) MAOBKDM4EATML3MBTL1LIMK1
SCHEMBL16613827 0.96 MAOB (0.35) MAOBKDM4EATML3MBTL1KDR
SCHEMBL16613825 0.96 MAOB (0.35) MAOBATMKDRLIMK1METTL3
SCHEMBL16613816 0.96 MAOB (0.35) MAOBATMKDRLIMK1METTL3
SCHEMBL16613653 0.96 MAOB (0.35) MAOBKDM4EATML3MBTL1LIMK1

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