SCHEMBL15089185

SCHEMBL15089185

c1ccc(-n2c3ccccc3c3cc(-c4cccc(N5c6cc7c(cc6-c6ccc(-c8ccccn8)c8cccc5c68)c5cc(-c6ccccn6)ccc5n7-c5cccc(-c6ccc7c(c6)c6ccccc6n7-c6ccccc6)n5)n4)ccc32)cc1

nearest known ligand 0.32

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
NPY5R Q15761 1/20 0.32
MAPK14 Q16539 1/20 0.32
IRAK4 Q9NWZ3 1/20 0.31
KDM4E B2RXH2 1/20 0.30
ATM Q13315 1/20 0.30
L3MBTL1 Q9Y468 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
SCHEMBL15089173 0.93 MAPK14 (0.35) NPY5RMAPK14IRAK4
SCHEMBL15089065 0.92 PDE6D (0.34) NPY5RMAPK14IRAK4KDM4EATM
SCHEMBL15089241 0.90 PDE6D (0.33) NPY5RMAPK14IRAK4KDM4EATM
SCHEMBL15088824 0.89 KDM4E (0.32) KDM4EATML3MBTL1
SCHEMBL15089196 0.89 MAPK14 (0.34) NPY5RMAPK14KDM4EATML3MBTL1
SCHEMBL15089129 0.88 PDE6D (0.34) NPY5RIRAK4KDM4EATML3MBTL1
SCHEMBL15089219 0.88 MAPK14 (0.36) NPY5RMAPK14
SCHEMBL15089175 0.87 HTR1A (0.34) NPY5RMAPK14KDM4EATML3MBTL1
SCHEMBL15089177 0.87 MAPK14 (0.35) NPY5RMAPK14
SCHEMBL15088925 0.87 PDE6D (0.37) KDM4EATML3MBTL1

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