SCHEMBL5261206

SCHEMBL5261206

Cc1cccc2nc(CCNc3ncnc4c3ncn4COCC[Si](C)(C)C)n(-c3cccc(C#N)c3)c(=O)c12

nearest known ligand 0.45

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
PIK3CD O00329 11/20 0.45
PIK3R1 P27986 5/20 0.45
PIK3CB P42338 3/20 0.40
PIK3CG P48736 2/20 0.40
TMIGD3 P0DMS9 2/20 0.34
ADORA2A P29274 2/20 0.34
ADORA1 P30542 2/20 0.34
ADORA2B P29275 1/20 0.34
CDK1 P06493 2/20 0.32
PRKCA P17252 2/20 0.32
PIK3R2 O00459 2/20 0.31
YTHDC1 Q96MU7 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
SCHEMBL5264169 0.90 PIK3CD (0.47) PIK3CDPIK3R1PIK3CBPIK3CGTMIGD3
SCHEMBL5263029 0.90 PIK3CD (0.47) PIK3CDPIK3R1PIK3CBPIK3CGTMIGD3
SCHEMBL5260703 0.87 PIK3CD (0.44) PIK3CDPIK3R1PIK3CBPIK3CGTMIGD3
SCHEMBL5260944 0.86 PIK3CD (0.45) PIK3CDPIK3R1PIK3CBPIK3CGTMIGD3
SCHEMBL356019 0.85 PIK3CD (0.47) PIK3CDPIK3R1PIK3CBPIK3CGPIK3R2
SCHEMBL5607075 0.79 PIK3CD (0.41) PIK3CDPIK3R1PIK3CBPIK3CGPIK3R2
SCHEMBL5261257 0.78 PIK3CD (0.57) PIK3CDPIK3R1PIK3CBPIK3CG
SCHEMBL1637431 0.78 PIK3CG (0.46) PIK3CDPIK3R1PIK3CBPIK3CGPIK3R2
SCHEMBL5262936 0.76 PIK3CD (0.35) PIK3CDPIK3R1PIK3CBPIK3CG
SCHEMBL356477 0.75 PIK3CD (0.48) PIK3CDPIK3R1PIK3CBPIK3CGPIK3R2

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