SCHEMBL15089181

SCHEMBL15089181

c1ccc(C2(c3ccccc3)c3ccccc3-c3cc4c(cc32)N(c2ccc(-n3c5ccccc5c5ccccc53)cc2)c2cccc3cccc-4c23)cc1

nearest known ligand 0.37

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
PDE6D O43924 1/20 0.37
KDM4E B2RXH2 2/20 0.33
ATM Q13315 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
MEN1 O00255 1/20 0.31
LMNA P02545 1/20 0.31
MAPT P10636 1/20 0.31
OPRK1 P41145 1/20 0.31
KMT2A Q03164 1/20 0.31
SMN1; SMN2 Q16637 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
SCHEMBL15089221 0.93 KDM4E (0.33) PDE6DKDM4EATML3MBTL1MEN1
SCHEMBL15089225 0.90 PDE6D (0.35) PDE6DKDM4EATML3MBTL1
SCHEMBL15089222 0.88 PDE6D (0.31) PDE6D
SCHEMBL15089189 0.86 PDE6D (0.51) PDE6DKDM4EMEN1LMNAMAPT
SCHEMBL15089190 0.86 PDE6D (0.31) PDE6D
SCHEMBL15088992 0.86 PDE6D (0.36) PDE6DKDM4EATML3MBTL1MEN1
SCHEMBL18810837 0.85 KDM4E (0.30) PDE6DKDM4EATML3MBTL1
SCHEMBL15089182 0.84 PDE6D (0.32) PDE6D
SCHEMBL18810930 0.84 KDM4E (0.30) KDM4EATML3MBTL1
SCHEMBL15089213 0.83 KDM4E (0.40) PDE6DKDM4EMEN1LMNAMAPT

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