SCHEMBL15088924

SCHEMBL15088924

c1cc(N2c3cc4c(cc3-c3cccc5cccc2c35)c2ccccc2n4-c2cccc(-n3c4ccccc4c4ccccc43)n2)nc(-n2c3ccccc3c3ccccc32)c1

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDE6D O43924 1/20 0.36
POLB P06746 1/20 0.35
MEN1 O00255 3/20 0.35
KMT2A Q03164 3/20 0.35
ALDH1A1 P00352 5/20 0.33
KDM4E B2RXH2 1/20 0.33
GAA P10253 1/20 0.33
TSHR P16473 3/20 0.32
MAPK1 P28482 3/20 0.32
HSD17B10 Q99714 3/20 0.32
HPGD P15428 3/20 0.32
CASP1 P29466 3/20 0.32
HIF1A Q16665 2/20 0.32
L3MBTL1 Q9Y468 2/20 0.32
TP53 P04637 1/20 0.32
CASP7 P55210 1/20 0.32
TUBB4A P04350 1/20 0.32
TUBB P07437 1/20 0.32
TUBA3C P0DPH7 1/20 0.32
TUBA1B P68363 1/20 0.32

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
SCHEMBL15089153 0.93 KDM4E (0.41) PDE6DPOLBMEN1KMT2AALDH1A1
SCHEMBL15089287 0.91 PDE6D (0.43) PDE6DPOLBMEN1KMT2A
SCHEMBL15089092 0.90 PDE6D (0.39) PDE6DPOLBMEN1KMT2AALDH1A1
SCHEMBL15088906 0.88 KDM4E (0.46) PDE6DPOLBMEN1KMT2AALDH1A1
SCHEMBL15089061 0.87 NPY5R (0.35) PDE6DPOLBMEN1KMT2AALDH1A1
SCHEMBL15089337 0.87 POLB (0.31) PDE6DPOLBALDH1A1L3MBTL1
SCHEMBL15089253 0.86 KDM4E (0.36) PDE6DPOLBMEN1KMT2AALDH1A1
SCHEMBL15089161 0.86 PDE6D (0.39) PDE6DMEN1KMT2AALDH1A1KDM4E
SCHEMBL15088976 0.85 MAPK14 (0.37) PDE6DALDH1A1KDM4EGAATSHR
SCHEMBL15088925 0.85 PDE6D (0.37) PDE6DPOLBKDM4EL3MBTL1ATM

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