SCHEMBL15089196

SCHEMBL15089196

c1ccc(N2c3cc4c(cc3-c3ccc(-c5ccccn5)c5cccc2c35)c2cc(-c3ccccn3)ccc2n4-c2ccccc2)cc1

nearest known ligand 0.34

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
MAPK14 Q16539 1/20 0.34
HTR1A P08908 1/20 0.33
HTR7 P34969 1/20 0.33
PIM1 P11309 1/20 0.32
PIM3 Q86V86 1/20 0.32
NPY5R Q15761 1/20 0.31
DHFR P00374 1/20 0.31
PRMT5 O14744 1/20 0.30
GRM5 P41594 1/20 0.30
DHODH Q02127 1/20 0.30
PDK2 Q15119 1/20 0.30
KDM4E B2RXH2 1/20 0.30
ATM Q13315 1/20 0.30
L3MBTL1 Q9Y468 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
SCHEMBL15089211 0.96 MAPK14 (0.33) MAPK14HTR1AHTR7PIM1PIM3
SCHEMBL15089219 0.95 MAPK14 (0.36) MAPK14HTR1AHTR7PIM1PIM3
SCHEMBL15089175 0.93 HTR1A (0.34) MAPK14HTR1AHTR7NPY5RDHFR
SCHEMBL15089200 0.93 GRM5 (0.36) MAPK14HTR1AHTR7PIM1PIM3
SCHEMBL15089177 0.92 MAPK14 (0.35) MAPK14HTR1AHTR7PIM1PIM3
SCHEMBL15089170 0.92 TSHR (0.32) MAPK14GRM5DHODH
SCHEMBL15088894 0.92 GRM5 (0.32) MAPK14NPY5RGRM5
SCHEMBL15088930 0.90 GRM5 (0.33) MAPK14HTR1AHTR7NPY5RGRM5
SCHEMBL15089024 0.89 PDE6D (0.39) MAPK14HTR1AHTR7PIM1PIM3
SCHEMBL15089185 0.89 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