SCHEMBL13715993

SCHEMBL13715993

CCCCn1c2c(cc(C)c1=O)CCCCC2

nearest known ligand 0.67

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CNR2 P34972 12/20 0.67
CNR1 P21554 8/20 0.62
NPC1 O15118 5/20 0.43
LMNA P02545 4/20 0.42
RAB9A P51151 4/20 0.42
HTT P42858 2/20 0.42
SMN1; SMN2 Q16637 2/20 0.42
NR2F2 P24468 1/20 0.42
PDE1A P54750 1/20 0.39
PDE1B Q01064 1/20 0.39
PDE4D Q08499 1/20 0.39
PDE1C Q14123 1/20 0.39
SLC2A1 P11166 3/20 0.39
PAX8 Q06710 2/20 0.39
MEN1 O00255 2/20 0.39
KMT2A Q03164 2/20 0.39
NPSR1 Q6W5P4 2/20 0.39
KDM4E B2RXH2 1/20 0.39
ALDH1A1 P00352 1/20 0.39
NTSR1 P30989 1/20 0.39

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
SCHEMBL5538681 0.87 CNR2 (0.55) CNR2CNR1HTTSMN1; SMN2MEN1
SCHEMBL216656 0.84 CNR2 (0.66) CNR2CNR1NPC1LMNARAB9A
SCHEMBL2736528 0.84 CNR2 (0.66) CNR2CNR1NPC1LMNARAB9A
SCHEMBL13716013 0.83 CNR2 (0.62) CNR2CNR1NPC1LMNARAB9A
SCHEMBL216352 0.82 CNR2 (0.79) CNR2CNR1
SCHEMBL217768 0.81 CNR2 (0.60) CNR2CNR1NPC1LMNARAB9A
SCHEMBL217087 0.81 CNR2 (0.63) CNR2CNR1NPC1PDE1APDE1B
SCHEMBL217884 0.81 CNR2 (0.77) CNR2CNR1
SCHEMBL3177343 0.81 CNR2 (1.00) CNR2CNR1NPC1
SCHEMBL14215468 0.81 CNR2 (0.47) CNR2CNR1

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
EP-1357111-B1 2-PYRIDONE DERIVATIVES HAVING AFFINITY FOR CANNABINOID TYPE 2 RECEPTOR SHIONOGI & CO (JP) 2009-08-05 EP disclosed