SCHEMBL15089110

SCHEMBL15089110

c1ccc(-c2ncnc(N3c4cc5c(cc4-c4cccc6cccc3c46)c3ccccc3n5-c3ccccc3)n2)cc1

nearest known ligand 0.36

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
PDE6D O43924 1/20 0.36
KDM4E B2RXH2 1/20 0.35
ATM Q13315 1/20 0.35
L3MBTL1 Q9Y468 1/20 0.35
IL1R1 P14778 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
SCHEMBL15088909 0.94 PDE6D (0.35) PDE6DKDM4EATML3MBTL1
SCHEMBL15089118 0.90 PDE6D (0.39) PDE6DKDM4EATML3MBTL1IL1R1
SCHEMBL15089262 0.86 PDE6D (0.38) PDE6D
SCHEMBL15089124 0.86 KDM4E (0.40) PDE6DKDM4EATML3MBTL1
SCHEMBL15089133 0.85 PDE6D (0.35) PDE6DKDM4EATML3MBTL1
SCHEMBL15089117 0.85 PDE6D (0.38) PDE6DKDM4EATML3MBTL1
SCHEMBL15088952 0.83 PDE6D (0.38) PDE6DKDM4EATML3MBTL1
SCHEMBL15088905 0.83 L3MBTL1 (0.46) PDE6DKDM4EATML3MBTL1
SCHEMBL15089248 0.82 PDE6D (0.43) PDE6DKDM4EATML3MBTL1
SCHEMBL15089126 0.82 PDE6D (0.43) PDE6DKDM4EATML3MBTL1IL1R1

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