SCHEMBL12583545

SCHEMBL12583545

CC(C)Cn1c(N2CCN(C(=O)[C@H](C)O)CC2)nc2c(N3CCOCC3)nc(-c3cnc(N)nc3)nc21

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PIK3CA P42336 18/20 0.59
PIK3CD O00329 10/20 0.59
MTOR P42345 6/20 0.59
PIK3CB P42338 6/20 0.59
PIK3CG P48736 5/20 0.59
PIK3C2A O00443 1/20 0.59
PIK3C2B O00750 1/20 0.59
STK10 O94804 1/20 0.59
PAK4 O96013 1/20 0.59
ABL1 P00519 1/20 0.59
EGFR P00533 1/20 0.59
FGR P09769 1/20 0.59
FER P16591 1/20 0.59
PRKCA P17252 1/20 0.59
JAK1 P23458 1/20 0.59
TEC P42680 1/20 0.59
SYK P43405 1/20 0.59
PRKDC P78527 1/20 0.59
MAP3K9 P80192 1/20 0.59
BTK Q06187 1/20 0.59

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
SCHEMBL336279 1.00 PIK3CA (0.59) PIK3CAPIK3CDMTORPIK3CBPIK3CG
SCHEMBL13383056 1.00 PIK3CA (0.59) PIK3CAPIK3CDMTORPIK3CBPIK3CG
SCHEMBL336247 0.92 PIK3CA (0.53) PIK3CAPIK3CDMTORPIK3CBPIK3CG
SCHEMBL336955 0.91 PIK3CA (0.51) PIK3CAPIK3CDMTORPIK3CBPIK3CG
SCHEMBL336595 0.91 PIK3CA (0.51) PIK3CAPIK3CDMTORPIK3CBPIK3CG
SCHEMBL799342 0.91 PIK3CA (0.51) PIK3CAPIK3CDMTORPIK3CBPIK3CG
SCHEMBL336831 0.91 PIK3CA (0.57) PIK3CAPIK3CDMTORPIK3CBPIK3CG
SCHEMBL336663 0.90 PIK3CA (0.56) PIK3CAPIK3CDMTORPIK3CBPIK3CG
SCHEMBL799594 0.90 PIK3CA (0.55) PIK3CAPIK3CDMTORPIK3CBPIK3CG
SCHEMBL336843 0.90 PIK3CA (0.55) PIK3CAPIK3CDMTORPIK3CBPIK3CG

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
EP-2336132-A1 MORPHOLINOPURINE DERIVATIVE Daiichi Sankyo Company, Limited (JP) 2011-06-22 EP disclosed