SCHEMBL8216639

SCHEMBL8216639

Cc1ccc(-c2nc(N3CCOCC3)c3sc(CN4CCN(C(=O)[C@H](C)O)CC4)c(C)c3n2)cn1

nearest known ligand 0.81

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PIK3CA P42336 19/20 0.81
PIK3CD O00329 12/20 0.81
MTOR P42345 11/20 0.81
PIK3CB P42338 10/20 0.81
PIK3CG P48736 10/20 0.81
PIK3C2A O00443 1/20 0.81
PIK3C2B O00750 1/20 0.81
STK10 O94804 1/20 0.81
PAK4 O96013 1/20 0.81
ABL1 P00519 1/20 0.81
EGFR P00533 1/20 0.81
FGR P09769 1/20 0.81
FER P16591 1/20 0.81
PRKCA P17252 1/20 0.81
JAK1 P23458 1/20 0.81
TEC P42680 1/20 0.81
SYK P43405 1/20 0.81
PRKDC P78527 1/20 0.81
MAP3K9 P80192 1/20 0.81
BTK Q06187 1/20 0.81

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
SCHEMBL1182108 0.92 PIK3CA (0.84) PIK3CAPIK3CDMTORPIK3CBPIK3CG
SCHEMBL1182111 0.92 PIK3CA (0.84) PIK3CAPIK3CDMTORPIK3CBPIK3CG
SCHEMBL11985345 0.91 PIK3CA (0.88) PIK3CAPIK3CDMTORPIK3CBPIK3CG
SCHEMBL1180645 0.91 PIK3CA (0.77) PIK3CAPIK3CDMTORPIK3CBPIK3CG
SCHEMBL1180975 0.91 PIK3CA (0.77) PIK3CAPIK3CDMTORPIK3CBPIK3CG
SCHEMBL1180642 0.91 PIK3CA (0.77) PIK3CAPIK3CDMTORPIK3CBPIK3CG
SCHEMBL1180972 0.91 PIK3CA (0.77) PIK3CAPIK3CDMTORPIK3CBPIK3CG
SCHEMBL1180569 0.90 PIK3CA (0.76) PIK3CAPIK3CDMTORPIK3CBPIK3CG
SCHEMBL1180570 0.90 PIK3CA (0.76) PIK3CAPIK3CDMTORPIK3CBPIK3CG
SCHEMBL1180176 0.90 PIK3CA (0.75) 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
WO-2008070740-A1 PHOSPHOINOSITIDE 3-KINASE INHIBITOR COMPOUNDS AND METHODS OF USE F.HOFFMANN-LA ROCHE AG (CH) 2008-06-12 WO disclosed