SCHEMBL5340752

SCHEMBL5340752

CC(C)(C)NC(=O)c1cccn2c(-c3ccc(Cl)cc3)c(-c3ccc(Br)cc3)nc12

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CNR1 P21554 1/20 0.53
AKT1 P31749 3/20 0.42
AKT2 P31751 3/20 0.42
TUBB4A P04350 1/20 0.39
TUBB P07437 1/20 0.39
TUBA3C P0DPH7 1/20 0.39
TUBA1B P68363 1/20 0.39
TUBA4A P68366 1/20 0.39
TUBB4B P68371 1/20 0.39
TUBB3 Q13509 1/20 0.39
TUBB2A Q13885 1/20 0.39
TUBB8 Q3ZCM7 1/20 0.39
TUBA3E Q6PEY2 1/20 0.39
TUBA1A Q71U36 1/20 0.39
TUBA1C Q9BQE3 1/20 0.39
TUBB6 Q9BUF5 1/20 0.39
TUBB2B Q9BVA1 1/20 0.39
TUBB1 Q9H4B7 1/20 0.39
GRIA1 P42261 3/20 0.39
AURKA O14965 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
SCHEMBL5341869 0.84 AKT2 (0.47) AKT1AKT2TUBB4ATUBBTUBA3C
SCHEMBL5318511 0.84 AURKA (0.55) CNR1AKT1AKT2TUBB4ATUBB
SCHEMBL5339960 0.82 CNR1 (0.56) CNR1AKT1AKT2
SCHEMBL5318509 0.81 CNR1 (0.55) CNR1GRIA1
SCHEMBL5333928 0.80 CNR1 (0.58) CNR1AKT1AKT2SLC2A1TSPO
SCHEMBL5337928 0.78 AKT1 (0.52) AKT1AKT2GRIA1TSPO
SCHEMBL5338205 0.77 CNR1 (0.57) CNR1AKT1AKT2TUBB4ATUBB
SCHEMBL5347257 0.77 CNR1 (0.57) CNR1AKT1AKT2TUBB4ATUBB
SCHEMBL5478849 0.76 AKT1 (0.55) AKT1AKT2GRIA1
SCHEMBL5340645 0.74 AKT1 (0.54) AKT1AKT2GRIA1

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