SCHEMBL4747148

SCHEMBL4747148

Cn1c2nc(=O)n(CCCN3CCCC3)c(=O)c-2nc2ccc(NCCCN3CCCC3)cc21

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HRH3 Q9Y5N1 2/20 0.39
RAD52 P43351 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.38
PGK1 P00558 1/20 0.38
OPRK1 P41145 1/20 0.37
MC4R P32245 3/20 0.37
LCK P06239 1/20 0.37
EGFR P00533 1/20 0.37
KMT2A Q03164 2/20 0.37
NPSR1 Q6W5P4 2/20 0.37
MEN1 O00255 1/20 0.37
HTT P42858 1/20 0.37
TLR9 Q9NR96 1/20 0.36
TLR8 Q9NR97 1/20 0.36
TLR7 Q9NYK1 1/20 0.36
S100A4 P26447 1/20 0.36
MC5R P33032 1/20 0.36
MC3R P41968 1/20 0.36
MC1R Q01726 1/20 0.36
MAPT P10636 1/20 0.36

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
SCHEMBL4743800 0.92 HRH3 (0.38) HRH3PGK1MC4RLCKEGFR
SCHEMBL14069128 0.87 MC4R (0.41) HRH3MC4REGFRKMT2AMEN1
SCHEMBL4748222 0.86 HRH3 (0.47) HRH3L3MBTL1MC4RTLR9TLR8
SCHEMBL4744848 0.86 GSR (0.40) HRH3MC4RTLR9
SCHEMBL4744753 0.86 ACP1 (0.40) HRH3MC4RACP1
SCHEMBL4744550 0.84 TMEM97 (0.47) MC4R
SCHEMBL4747131 0.82 DRD3 (0.39) RAD52MC4RLCK
SCHEMBL4743769 0.79 LCK (0.41) RAD52L3MBTL1MC4RLCKKMT2A
SCHEMBL4746291 0.76 TMEM97 (0.49) MC4R
SCHEMBL4747855 0.75 DRD3 (0.40) RAD52MC4RLCK

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2008114009-A1 10H-BENZO(G)PTERDINE-2,4-DIONE COMPOUNDS FOR THE TREATMENT OF PROLIFERATIVE DISORDERS CAMBRIDGE ENTERPRISE LTD. (GB) 2008-09-25 WO disclosed
WO-2008114009-A1 10H-BENZO(G)PTERDINE-2,4-DIONE COMPOUNDS FOR THE TREATMENT OF PROLIFERATIVE DISORDERS CAMBRIDGE ENTERPRISE LTD. (GB) 2008-09-25 WO disclosed