SCHEMBL15089221

SCHEMBL15089221

c1ccc(C2(c3ccccc3)c3ccccc3-c3cc4c(cc32)N(c2cccc(-n3c5ccccc5c5ccccc53)c2)c2cccc3cccc-4c23)cc1

nearest known ligand 0.33

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.33
ATM Q13315 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
PDE6D O43924 1/20 0.32
MEN1 O00255 1/20 0.30
LMNA P02545 1/20 0.30
MAPT P10636 1/20 0.30
OPRK1 P41145 1/20 0.30
KMT2A Q03164 1/20 0.30
SMN1; SMN2 Q16637 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
SCHEMBL15089181 0.93 PDE6D (0.37) KDM4EATML3MBTL1PDE6DMEN1
SCHEMBL15089225 0.91 PDE6D (0.35) KDM4EATML3MBTL1PDE6D
SCHEMBL15088991 0.86 PGR (0.33) KDM4EATML3MBTL1PDE6DMEN1
SCHEMBL15089190 0.85 PDE6D (0.31) PDE6D
SCHEMBL15089222 0.85 PDE6D (0.31) PDE6D
SCHEMBL15089226 0.85 CYP1A2 (0.32) PDE6DMAPT
SCHEMBL15089182 0.84 PDE6D (0.32) PDE6D
SCHEMBL18810837 0.82 KDM4E (0.30) KDM4EATML3MBTL1PDE6D
SCHEMBL15089189 0.81 PDE6D (0.51) KDM4EPDE6DMEN1LMNAMAPT
SCHEMBL18810930 0.81 KDM4E (0.30) 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