SCHEMBL15088913

SCHEMBL15088913

Cc1cccc(N2c3cc4c(cc3-c3cccc5cccc2c35)c2cc(-c3ccccn3)ccc2n4-c2cccc(C)c2)c1

nearest known ligand 0.34

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
GRM5 P41594 4/20 0.34
IRAK4 Q9NWZ3 1/20 0.33
POLB P06746 1/20 0.33
NPY5R Q15761 1/20 0.33
PDE6D O43924 1/20 0.32
TGFBR1 P36897 1/20 0.32
ALDH1A1 P00352 1/20 0.31
HTT P42858 1/20 0.31
GFER P55789 1/20 0.31
KMT2A Q03164 1/20 0.31
L3MBTL1 Q9Y468 1/20 0.31
HTR1A P08908 1/20 0.31
HTR7 P34969 1/20 0.31
DHFR P00374 2/20 0.31
ADORA3 P0DMS8 1/20 0.31
MAPT P10636 1/20 0.31
MAPK14 Q16539 1/20 0.31
HTR2C P28335 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
SCHEMBL15088836 0.97 GRM5 (0.33) GRM5IRAK4POLBNPY5RPDE6D
SCHEMBL15088785 0.92 PDE6D (0.33) GRM5IRAK4NPY5RPDE6DALDH1A1
SCHEMBL15089042 0.91 NPY5R (0.35) GRM5IRAK4NPY5RPDE6DALDH1A1
SCHEMBL15088930 0.90 GRM5 (0.33) GRM5IRAK4POLBNPY5RTGFBR1
SCHEMBL15089040 0.90 PDE6D (0.39) GRM5PDE6DHTR1AHTR7DHFR
SCHEMBL15089024 0.90 PDE6D (0.39) GRM5IRAK4NPY5RPDE6DALDH1A1
SCHEMBL15089358 0.88 PDE6D (0.39) GRM5PDE6DHTR1AHTR7DHFR
SCHEMBL15089032 0.88 PDE6D (0.35) GRM5NPY5RPDE6DL3MBTL1HTR1A
SCHEMBL15089239 0.87 PDE6D (0.44) GRM5IRAK4PDE6DALDH1A1HTR1A
SCHEMBL15089250 0.87 ABL1 (0.36) GRM5POLBPDE6DTGFBR1KMT2A

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