SCHEMBL5337716

SCHEMBL5337716

O=C(c1cccn2c(-c3ccc(Cl)cc3)c(-c3ccc(Cl)cc3)nc12)N1CCCC1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CNR1 P21554 1/20 0.55
AKT1 P31749 3/20 0.49
AKT2 P31751 3/20 0.49
GRIA1 P42261 2/20 0.48
ALOX15 P16050 2/20 0.48
NPC1 O15118 1/20 0.48
LMNA P02545 1/20 0.48
RAB9A P51151 1/20 0.48
KCNK3 O14649 4/20 0.47
KCNK9 Q9NPC2 4/20 0.47
KDM4E B2RXH2 2/20 0.47
ALDH1A1 P00352 2/20 0.47
HPGD P15428 2/20 0.47
CASP1 P29466 2/20 0.47
CASP7 P55210 2/20 0.47
HSD17B10 Q99714 2/20 0.47
GAA P10253 1/20 0.47
PDE4A P27815 1/20 0.47
PDE4B Q07343 1/20 0.47
PDE4C Q08493 1/20 0.47

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
SCHEMBL5340730 0.84 ALDH1A1 (0.56) GRIA1LMNAKDM4EALDH1A1HPGD
SCHEMBL5337928 0.83 AKT1 (0.52) AKT1AKT2GRIA1KDM4ECASP1
SCHEMBL5478849 0.81 AKT1 (0.55) AKT1AKT2GRIA1LMNAKDM4E
SCHEMBL5340645 0.80 AKT1 (0.54) AKT1AKT2GRIA1LMNAKDM4E
SCHEMBL5341869 0.78 AKT2 (0.47) AKT1AKT2GRIA1KDM4ECASP1
SCHEMBL5348576 0.76 AKT1 (0.65) AKT1AKT2NPC1LMNARAB9A
SCHEMBL5351210 0.76 CNR1 (0.54) CNR1AKT1AKT2NPC1RAB9A
SCHEMBL15071102 0.75 CNR1 (0.49) CNR1AKT1AKT2KDM4EALDH1A1
SCHEMBL5342230 0.75 CNR1 (0.56) CNR1AKT1AKT2NPC1RAB9A
SCHEMBL5318690 0.75 CNR1 (0.58) CNR1GRIA1ALOX15NPC1LMNA

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-2007086080-A2 NOVEL IMIDAZO[1,2-a]PYRIDINE CANNABINOID RECEPTOR LIGANDS AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM GLENMARK PHARMACEUTICALS LIMITED (IN) 2007-08-02 WO claimed
WO-2007086080-A2 NOVEL IMIDAZO[1,2-a]PYRIDINE CANNABINOID RECEPTOR LIGANDS AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM GLENMARK PHARMACEUTICALS LIMITED (IN) 2007-08-02 WO disclosed