SCHEMBL16613841

SCHEMBL16613841

c1ccc(-c2cc(-c3ccccc3)cc(-c3ccc4c(c3)c3ccc5c(ccn5-c5cccc(-c6ccccc6)c5)c3n4-c3cc(-c4ccccc4)cc(-c4ccccc4)c3)c2)cc1

nearest known ligand 0.35

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
METTL3 Q86U44 1/20 0.35
METTL14 Q9HCE5 1/20 0.35
MAOB P27338 1/20 0.34
WNK1 Q9H4A3 1/20 0.34
OPRD1 P41143 2/20 0.34
OPRM1 P35372 1/20 0.34
COMT P21964 6/20 0.33
FAAH O00519 1/20 0.33
ALDH1A1 P00352 1/20 0.33
HSP90AA1 P07900 1/20 0.33
PKM P14618 1/20 0.33
HTT P42858 1/20 0.33
ATM Q13315 1/20 0.33
MGLL Q99685 1/20 0.33
HTR1A P08908 1/20 0.31
HTR7 P34969 1/20 0.31
TET2 Q6N021 1/20 0.31
TET1 Q8NFU7 1/20 0.31
LIMK1 P53667 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
SCHEMBL16613832 1.00 METTL3 (0.35) METTL3METTL14MAOBWNK1OPRD1
SCHEMBL16613815 0.97 MAOB (0.34) METTL3METTL14MAOBWNK1OPRD1
SCHEMBL16613816 0.96 MAOB (0.35) METTL3METTL14MAOBWNK1FAAH
SCHEMBL16613825 0.96 MAOB (0.35) METTL3METTL14MAOBWNK1FAAH
SCHEMBL16613831 0.96 MAOB (0.35) METTL3METTL14MAOBWNK1FAAH
SCHEMBL16613796 0.95 MAOB (0.34) METTL3METTL14MAOBWNK1OPRD1
SCHEMBL16613839 0.95 MAOB (0.34) METTL3METTL14MAOBWNK1OPRD1
SCHEMBL16613833 0.95 MAOB (0.36) METTL3METTL14MAOBLIMK1
SCHEMBL16613840 0.94 MAOB (0.35) METTL3METTL14MAOBWNK1FAAH
SCHEMBL16613653 0.94 MAOB (0.35) METTL3METTL14MAOBWNK1FAAH

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