SCHEMBL15089317

SCHEMBL15089317

c1ccc(N2c3cccc4cccc(c34)-c3ccc4c(c32)c2ccccc2n4-c2cc(-c3ccccn3)nc(-c3ccccn3)n2)cc1

nearest known ligand 0.34

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GRM5 P41594 4/20 0.33
METAP1 P53582 5/20 0.33
ADORA3 P0DMS8 3/20 0.32
MAPT P10636 2/20 0.32
RAB9A P51151 2/20 0.32
TDP1 Q9NUW8 2/20 0.32
L3MBTL1 Q9Y468 2/20 0.32
MAPK1 P28482 2/20 0.32
KDM4E B2RXH2 2/20 0.32
ALDH1A1 P00352 2/20 0.32
PPP1CA P62136 1/20 0.32
HIF1A Q16665 1/20 0.32
NPC1 O15118 1/20 0.32
TP53 P04637 1/20 0.32
HPGD P15428 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
HSD17B10 Q99714 1/20 0.32
MAPK14 Q16539 1/20 0.32
PIK3CA P42336 1/20 0.31
PIK3CB P42338 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
SCHEMBL15089306 0.93 MAPT (0.35) GRM5MAPTMAPK1KDM4EALDH1A1
SCHEMBL15089340 0.90 METAP1 (0.34) METAP1ADORA3MAPK14PDE6D
SCHEMBL15088956 0.89 MAPT (0.34) GRM5METAP1MAPTRAB9ATDP1
SCHEMBL15089341 0.88 METAP1 (0.34) METAP1ADORA3RAB9AKDM4EALDH1A1
SCHEMBL15089272 0.86 KDM4E (0.40) MAPTTDP1L3MBTL1KDM4EALDH1A1
SCHEMBL15088936 0.86 GRM5 (0.36) GRM5METAP1MAPTRAB9ATDP1
SCHEMBL15089275 0.85 PDE6D (0.37) MAPTMAPK1HPGDHSD17B10TSHR
SCHEMBL15089316 0.85 PDE6D (0.34) GRM5METAP1RAB9AKDM4EALDH1A1
SCHEMBL15088929 0.84 PDE6D (0.37) MAPTKDM4EALDH1A1MAPK14PDE6D
SCHEMBL15089372 0.84 PDE6D (0.39) MAPTL3MBTL1MAPK1KDM4EALDH1A1

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