SCHEMBL15089175

SCHEMBL15089175

c1ccc(-n2c3ccccc3c3cc(-c4cccc(N5c6cc7c(cc6-c6ccc(-c8ccccn8)c8cccc5c68)c5cc(-c6ccccn6)ccc5n7-c5cccc(-c6ccc7c(c6)c6ccccc6n7-c6ccccc6)c5)c4)ccc32)cc1

nearest known ligand 0.34

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
HTR1A P08908 1/20 0.34
HTR7 P34969 1/20 0.34
MAPK14 Q16539 1/20 0.33
GRM5 P41594 6/20 0.33
NPY5R Q15761 1/20 0.32
DHFR P00374 1/20 0.32
KDM4E B2RXH2 1/20 0.32
ATM Q13315 1/20 0.32
L3MBTL1 Q9Y468 1/20 0.32
MCL1 Q07820 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
SCHEMBL15089200 0.96 GRM5 (0.36) HTR1AHTR7MAPK14GRM5DHFR
SCHEMBL15089177 0.95 MAPK14 (0.35) HTR1AHTR7MAPK14NPY5RMCL1
SCHEMBL15089196 0.93 MAPK14 (0.34) HTR1AHTR7MAPK14GRM5NPY5R
SCHEMBL15089176 0.93 GRM5 (0.35) HTR1AHTR7MAPK14GRM5DHFR
SCHEMBL15089219 0.92 MAPK14 (0.36) HTR1AHTR7MAPK14NPY5RMCL1
SCHEMBL15089032 0.91 PDE6D (0.35) HTR1AHTR7MAPK14GRM5NPY5R
SCHEMBL15089211 0.91 MAPK14 (0.33) HTR1AHTR7MAPK14GRM5
SCHEMBL15089360 0.90 PDE6D (0.35) HTR1AHTR7MAPK14GRM5NPY5R
SCHEMBL15088930 0.89 GRM5 (0.33) HTR1AHTR7MAPK14GRM5NPY5R
SCHEMBL15089185 0.87 NPY5R (0.32) MAPK14NPY5RKDM4EATML3MBTL1

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