SCHEMBL530735

SCHEMBL530735

CC(C)(O)c1ccc(-c2cnc3c(n2)N(CC2CCCC2)CC(O)=N3)cn1

nearest known ligand 0.68

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
MTOR P42345 17/20 0.68
PIK3CA P42336 12/20 0.68
RPTOR Q8N122 9/20 0.59
MLST8 Q9BVC4 9/20 0.59
RICTOR Q6R327 2/20 0.59
MAPKAP1 Q9BPZ7 2/20 0.59
CSF1R P07333 2/20 0.59
SYK P43405 3/20 0.41
GSK3A P49840 1/20 0.41
PIK3CD O00329 1/20 0.41
FLT4 P35916 1/20 0.41
PIK3CB P42338 1/20 0.41
PIK3CG P48736 1/20 0.41
KCNH2 Q12809 1/20 0.41
PIK3C3 Q8NEB9 1/20 0.41
PI4KB Q9UBF8 1/20 0.41

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
SCHEMBL530988 0.92 MTOR (0.71) MTORPIK3CARPTORMLST8RICTOR
SCHEMBL138628 0.82 MTOR (0.98) MTORPIK3CARPTORMLST8RICTOR
SCHEMBL29522256 0.82 MTOR (0.98) MTORPIK3CARPTORMLST8RICTOR
SCHEMBL138732 0.81 MTOR (1.00) MTORPIK3CARPTORMLST8RICTOR
SCHEMBL29521669 0.81 MTOR (1.00) MTORPIK3CARPTORMLST8RICTOR
SCHEMBL530610 0.81 MTOR (0.61) MTORPIK3CARPTORMLST8RICTOR
SCHEMBL530692 0.80 MTOR (0.58) MTORPIK3CARPTORMLST8RICTOR
SCHEMBL138631 0.78 MTOR (0.91) MTORPIK3CARPTORMLST8RICTOR
SCHEMBL29522011 0.78 MTOR (0.91) MTORPIK3CARPTORMLST8RICTOR
SCHEMBL532015 0.77 MTOR (0.54) MTORPIK3CARPTORMLST8RICTOR

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-2598885-A1 BIOMARKER ASSAYS FOR DETECTING OR MEASURING INHIBITION OF TOR KINASE ACTIVITY Signal Pharmaceuticals, LLC (US) 2013-06-05 EP claimed
WO-2012016113-A1 BIOMARKER ASSAYS FOR DETECTING OR MEASURING INHIBITION OF TOR KINASE ACTIVITY SIGNAL PHARMACEUTICALS, LLC (US) 2012-02-02 WO claimed