SCHEMBL15089260

SCHEMBL15089260

c1ccc(-c2ccc3c(c2)c2cc4c(cc2n3-c2ccncc2)N(c2ccncc2)c2cccc3cccc-4c23)cc1

nearest known ligand 0.46

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
PDE6D O43924 1/20 0.46
ALDH1A1 P00352 2/20 0.38
KDM4E B2RXH2 1/20 0.38
HPGD P15428 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
MEN1 O00255 1/20 0.37
HSP90AA1 P07900 1/20 0.37
MAPT P10636 1/20 0.37
KMT2A Q03164 1/20 0.37
PIK3CA P42336 1/20 0.34
KCNH2 Q12809 1/20 0.32
PDE10A Q9Y233 1/20 0.32
MKNK1 Q9BUB5 1/20 0.32
TNF P01375 1/20 0.32
IMPDH2 P12268 1/20 0.31
HTR6 P50406 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
SCHEMBL15089143 0.99 PDE6D (0.45) PDE6DALDH1A1KDM4EHPGDSMN1; SMN2
SCHEMBL15089046 0.96 KDM4E (0.40) PDE6DALDH1A1KDM4EHPGDSMN1; SMN2
SCHEMBL15089369 0.92 PDE6D (0.53) PDE6DMEN1KMT2A
SCHEMBL15089338 0.92 PDE6D (0.50) PDE6DALDH1A1KDM4EMEN1HSP90AA1
SCHEMBL15089208 0.91 PDE6D (0.52) PDE6DALDH1A1KDM4EMEN1HSP90AA1
SCHEMBL15089370 0.89 PDE6D (0.50) PDE6DKDM4E
SCHEMBL15089355 0.89 PDE6D (0.37) PDE6DALDH1A1KDM4EHPGDSMN1; SMN2
SCHEMBL15089156 0.89 PDE6D (0.46) PDE6DALDH1A1KDM4EMEN1HSP90AA1
SCHEMBL15089154 0.89 HTT (0.41) PDE6DALDH1A1KDM4EMEN1MAPT
SCHEMBL15088862 0.89 PIK3CA (0.38) PDE6DALDH1A1MEN1HSP90AA1MAPT

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