SCHEMBL2365460

SCHEMBL2365460

Cc1nc(N2C=CNN2)ccc1-c1cnc2c(n1)N(C(C)CO)C(=O)CN2

nearest known ligand 0.50

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
MTOR P42345 20/20 0.50
RPTOR Q8N122 16/20 0.50
MLST8 Q9BVC4 16/20 0.50
PIK3CA P42336 8/20 0.42
CSF1R P07333 2/20 0.42
PRKDC P78527 1/20 0.42
PDE3B Q13370 1/20 0.42
PDE3A Q14432 1/20 0.42
PIK3CD O00329 1/20 0.31
FLT4 P35916 1/20 0.31
PIK3CB P42338 1/20 0.31
PIK3CG P48736 1/20 0.31
KCNH2 Q12809 1/20 0.31
PIK3C3 Q8NEB9 1/20 0.31
PI4KB Q9UBF8 1/20 0.31

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
SCHEMBL138444 0.78 MTOR (0.56) MTORRPTORMLST8PIK3CACSF1R
SCHEMBL22675179 0.68 MTOR (0.69) MTORRPTORMLST8PIK3CACSF1R
SCHEMBL29522317 0.66 MTOR (0.72) MTORRPTORMLST8PIK3CACSF1R
SCHEMBL138084 0.66 MTOR (0.72) MTORRPTORMLST8PIK3CACSF1R
SCHEMBL22203977 0.64 MTOR (0.65) MTORRPTORMLST8PIK3CACSF1R
SCHEMBL137335 0.61 MTOR (0.53) MTORRPTORMLST8PIK3CACSF1R
SCHEMBL22675182 0.60 MTOR (0.63) MTORRPTORMLST8PIK3CACSF1R
SCHEMBL153310 0.60 MTOR (0.57) MTORRPTORMLST8PIK3CACSF1R
Cc-115 SCHEMBL14877034 0.60 MTOR (0.69) MTORRPTORMLST8PIK3CACSF1R
Cc-115 SCHEMBL29354401 0.60 MTOR (0.69) MTORRPTORMLST8PIK3CACSF1R

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
EP-2358718-A1 MTOR KINASE INHIBITORS FOR ONCOLOGY INDICATIONS AND DISEASES ASSOCIATED WITH THE MTOR/P13K/AKT PATHWAY Signal Pharmaceuticals, LLC (US) 2011-08-24 EP disclosed
WO-2010062571-A1 MTOR KINASE INHIBITORS FOR ONCOLOGY INDICATIONS AND DISEASES ASSOCIATED WITH THE MTOR/P13K/AKT PATHWAY SIGNAL PHARMACEUTICALS, LLC (US) 2010-06-03 WO disclosed