SCHEMBL5333928

SCHEMBL5333928

CC(C)(C)NC(=O)c1cc(Cl)cn2c(-c3ccc(Cl)cc3)c(-c3ccc(Cl)cc3)nc12

nearest known ligand 0.58

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
CNR1 P21554 2/20 0.58
MEN1 O00255 1/20 0.41
ALDH1A1 P00352 1/20 0.41
MAPT P10636 1/20 0.41
KMT2A Q03164 1/20 0.41
TSPO P30536 2/20 0.41
POLB P06746 2/20 0.41
GMNN O75496 1/20 0.41
LMNA P02545 1/20 0.41
CYP3A4 P08684 1/20 0.41
BLM P54132 1/20 0.41
NPSR1 Q6W5P4 1/20 0.41
AKT1 P31749 1/20 0.39
AKT2 P31751 1/20 0.39
PTGS2 P35354 1/20 0.39
SLC2A1 P11166 1/20 0.39
APEX1 P27695 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
SCHEMBL5317388 0.93 CNR1 (0.51) CNR1MEN1ALDH1A1MAPTKMT2A
SCHEMBL5340360 0.82 AKT1 (0.46) MAPTTSPOPOLBGMNNLMNA
SCHEMBL5341242 0.81 AKT1 (0.42) CNR1MAPTTSPOPOLBGMNN
Hydrochloric Acid SCHEMBL5348937 0.81 CNR1 (0.56) CNR1AKT1AKT2PTGS2SLC2A1
SCHEMBL5340752 0.80 CNR1 (0.53) CNR1TSPOAKT1AKT2SLC2A1
SCHEMBL5337475 0.78 CNR1 (0.50) CNR1ALDH1A1MAPTLMNA
SCHEMBL5335061 0.77 AKT1 (0.42) MAPTTSPOPOLBGMNNLMNA
SCHEMBL5341397 0.77 AKT1 (0.45) MAPTTSPOPOLBGMNNLMNA
SCHEMBL5335616 0.77 AKT1 (0.45) MAPTTSPOPOLBGMNNLMNA
SCHEMBL5344434 0.76 TSPO (0.45) MEN1ALDH1A1MAPTKMT2ATSPO

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