SCHEMBL5337980

SCHEMBL5337980

CC(C)(C)NC(=O)c1ccc2nc(-c3ccc(Cl)cc3)c(-c3ccc(Cl)cc3Cl)n2c1

nearest known ligand 0.53

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
CNR1 P21554 10/20 0.53
ALPL P05186 1/20 0.45
SLC2A1 P11166 2/20 0.43
MEN1 O00255 1/20 0.42
ALDH1A1 P00352 1/20 0.42
MAPT P10636 1/20 0.42
KMT2A Q03164 1/20 0.42
OPRL1 P41146 1/20 0.42
TOP2A P11388 1/20 0.41
AKT1 P31749 2/20 0.40
AKT2 P31751 2/20 0.40

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
SCHEMBL5347257 0.83 CNR1 (0.57) CNR1SLC2A1MEN1ALDH1A1MAPT
SCHEMBL5338205 0.83 CNR1 (0.57) CNR1SLC2A1MEN1ALDH1A1MAPT
SCHEMBL4080188 0.81 CNR1 (0.77) CNR1ALPLOPRL1
SCHEMBL5343515 0.76 CNR1 (0.48) CNR1SLC2A1ALDH1A1TOP2AAKT1
Hydrochloric Acid SCHEMBL5348937 0.72 CNR1 (0.56) CNR1SLC2A1AKT1AKT2
SCHEMBL5348158 0.71 AKT1 (0.60) AKT1AKT2
SCHEMBL5333928 0.71 CNR1 (0.58) CNR1SLC2A1MEN1ALDH1A1MAPT
SCHEMBL5343483 0.71 CYP1A2 (0.59) SLC2A1ALDH1A1MAPTAKT1AKT2
SCHEMBL5335420 0.70 NR4A2 (0.57) CNR1MEN1ALDH1A1MAPTKMT2A
SCHEMBL4085484 0.69 CNR1 (1.00) CNR1

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