SCHEMBL5348576

SCHEMBL5348576

CCOC(=O)c1cccn2c(-c3ccc(Cl)cc3)c(-c3ccc(Cl)cc3)nc12

nearest known ligand 0.65

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
AKT1 P31749 3/20 0.65
AKT2 P31751 3/20 0.65
CYP1A2 P05177 3/20 0.50
CYP2C9 P11712 3/20 0.50
CYP2C19 P33261 3/20 0.50
MEN1 O00255 1/20 0.50
CYP3A4 P08684 1/20 0.50
CYP2D6 P10635 1/20 0.50
KMT2A Q03164 1/20 0.50
TP53 P04637 1/20 0.46
RXFP1 Q9HBX9 1/20 0.46
TSPO P30536 2/20 0.45
SMN1; SMN2 Q16637 3/20 0.45
CYP19A1 P11511 1/20 0.45
NPC1 O15118 1/20 0.45
LMNA P02545 1/20 0.45
POLB P06746 1/20 0.45
RAB9A P51151 1/20 0.45
NPSR1 Q6W5P4 1/20 0.45
GABRA2 P47869 2/20 0.44

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
SCHEMBL5451404 0.89 AKT1 (0.54) AKT1AKT2CYP1A2CYP2C9CYP2C19
SCHEMBL5452695 0.89 AKT1 (0.54) AKT1AKT2CYP1A2CYP2C9CYP2C19
SCHEMBL5337928 0.82 AKT1 (0.52) AKT1AKT2TSPO
SCHEMBL5340819 0.80 AKT1 (0.46) AKT1AKT2CYP1A2CYP2C9CYP2C19
SCHEMBL5338476 0.80 GABRA2 (0.48) AKT1AKT2CYP1A2CYP2C9CYP2C19
SCHEMBL5343717 0.80 GABRA2 (0.48) AKT1AKT2CYP1A2CYP2C9CYP2C19
SCHEMBL5335250 0.80 GABRA2 (0.48) AKT1AKT2CYP1A2CYP2C9CYP2C19
SCHEMBL5478849 0.80 AKT1 (0.55) AKT1AKT2LMNA
SCHEMBL360182 0.79 AKT1 (1.00) AKT1AKT2
SCHEMBL5340645 0.79 AKT1 (0.54) AKT1AKT2LMNA

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
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