SCHEMBL5322233

SCHEMBL5322233

O=C(c1ccc2nc(-c3ccc(Cl)cc3)c(-c3ccc(Cl)cc3)n2c1)N1CCCCC1

nearest known ligand 0.64

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
CNR1 P21554 1/20 0.58
GABRA2 P47869 1/20 0.55
GABRB2 P47870 1/20 0.55
PDE4A P27815 2/20 0.49
PDE4B Q07343 2/20 0.49
PDE4C Q08493 2/20 0.49
PDE4D Q08499 2/20 0.49
HSD17B10 Q99714 1/20 0.49
HPGD P15428 1/20 0.48
F2RL1 P55085 1/20 0.48
AKT1 P31749 4/20 0.47
AKT2 P31751 4/20 0.47
SLC2A1 P11166 3/20 0.47
MEN1 O00255 1/20 0.47
KMT2A Q03164 1/20 0.47
KCNK3 O14649 1/20 0.46
KCNK9 Q9NPC2 1/20 0.46

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
SCHEMBL5337926 1.00 CNR1 (0.58) CNR1GABRA2GABRB2PDE4APDE4B
SCHEMBL5333907 0.92 CNR1 (0.53) CNR1GABRA2GABRB2HPGDF2RL1
SCHEMBL5341500 0.89 KMT2A (0.60) CNR1GABRA2GABRB2PDE4APDE4B
SCHEMBL5342501 0.89 CCNC (0.45) CNR1GABRA2GABRB2HPGDAKT1
SCHEMBL5345220 0.89 KDM4E (0.59) CNR1HPGDSLC2A1KMT2A
SCHEMBL5318714 0.89 POLB (0.56) CNR1GABRA2GABRB2HSD17B10HPGD
SCHEMBL5341068 0.89 SLC2A2 (0.52) CNR1SLC2A1
SCHEMBL5347128 0.88 L3MBTL3 (0.51) CNR1GABRA2GABRB2MEN1KMT2A
SCHEMBL15071127 0.87 F2RL1 (0.62) CNR1GABRA2GABRB2PDE4APDE4B
SCHEMBL5339197 0.86 CASP1 (0.49) CNR1GABRA2GABRB2HSD17B10HPGD

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