SCHEMBL5264169

SCHEMBL5264169

COc1cccc(-n2c(CCNc3ncnc4c3ncn4COCC[Si](C)(C)C)nc3cccc(C)c3c2=O)c1

nearest known ligand 0.47

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
PIK3CD O00329 10/20 0.47
PIK3R1 P27986 4/20 0.47
PIK3CG P48736 2/20 0.42
PIK3CB P42338 1/20 0.42
USP2 O75604 1/20 0.39
TP53 P04637 1/20 0.37
TMIGD3 P0DMS9 2/20 0.35
ADORA2A P29274 2/20 0.35
ADORA1 P30542 2/20 0.35
ADORA2B P29275 1/20 0.35
EPHB4 P54760 1/20 0.34

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
SCHEMBL5263029 0.92 PIK3CD (0.47) PIK3CDPIK3R1PIK3CGPIK3CBTMIGD3
SCHEMBL5260944 0.91 PIK3CD (0.45) PIK3CDPIK3R1PIK3CGPIK3CBUSP2
SCHEMBL5261206 0.90 PIK3CD (0.45) PIK3CDPIK3R1PIK3CGPIK3CBTMIGD3
SCHEMBL5260703 0.89 PIK3CD (0.44) PIK3CDPIK3R1PIK3CGPIK3CBTMIGD3
SCHEMBL356477 0.85 PIK3CD (0.48) PIK3CDPIK3R1PIK3CGPIK3CB
SCHEMBL5261257 0.80 PIK3CD (0.57) PIK3CDPIK3R1PIK3CGPIK3CB
SCHEMBL5607382 0.79 USP2 (0.44) PIK3CDPIK3R1PIK3CGPIK3CBUSP2
SCHEMBL5262936 0.77 PIK3CD (0.35) PIK3CDPIK3R1PIK3CGPIK3CB
SCHEMBL355382 0.77 PIK3CD (0.46) PIK3CDPIK3R1PIK3CGPIK3CB
SCHEMBL1637876 0.77 PIK3CD (0.48) PIK3CDPIK3R1PIK3CGPIK3CB

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-1761540-A1 QUINAZOLINONES AS INHIBITORS OF HUMAN PHOSPHATIDYLINOSITOL 3-KINASE DELTA ICOS CORPORATION (US) 2007-03-14 EP disclosed
WO-2005113556-A1 QUINAZOLINONES AS INHIBITORS OF HUMAN PHOSPHATIDYLINOSITOL 3-KINASE DELTA ICOS CORPORATION (US) 2005-12-01 WO disclosed