SCHEMBL15089341

SCHEMBL15089341

c1ccc(N2c3cccc4cccc(c34)-c3ccc4c(c32)c2ccccc2n4-c2nc(-c3ccccn3)cc(-c3ccccn3)n2)cc1

nearest known ligand 0.34

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
METAP1 P53582 10/20 0.34
MAPK14 Q16539 1/20 0.33
PDE6D O43924 1/20 0.32
ADORA3 P0DMS8 3/20 0.32
HTR2C P28335 1/20 0.31
KDM4E B2RXH2 2/20 0.30
NPC1 O15118 1/20 0.30
ALDH1A1 P00352 1/20 0.30
LMNA P02545 1/20 0.30
HPGD P15428 1/20 0.30
RAB9A P51151 1/20 0.30
SMN1; SMN2 Q16637 1/20 0.30
RXFP1 Q9HBX9 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
SCHEMBL15089320 0.92 HTT (0.36) METAP1MAPK14
SCHEMBL15088956 0.92 MAPT (0.34) METAP1MAPK14PDE6DKDM4ENPC1
SCHEMBL15089317 0.88 GRM5 (0.33) METAP1MAPK14PDE6DADORA3KDM4E
SCHEMBL15089340 0.88 METAP1 (0.34) METAP1MAPK14PDE6DADORA3
SCHEMBL15089316 0.87 PDE6D (0.34) METAP1MAPK14PDE6DHTR2CKDM4E
SCHEMBL15089372 0.86 PDE6D (0.39) MAPK14PDE6DKDM4ENPC1ALDH1A1
SCHEMBL15088958 0.86 METAP1 (0.32) METAP1MAPK14
SCHEMBL15089272 0.84 KDM4E (0.40) PDE6DKDM4ENPC1ALDH1A1LMNA
SCHEMBL15089278 0.84 PDE6D (0.37) PDE6D
SCHEMBL15088920 0.84 MAPT (0.37) MAPK14KDM4ENPC1ALDH1A1HPGD

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