SCHEMBL5259222

SCHEMBL5259222

Cc1cccc2nc(CCNc3nc(N)nc4[nH]cnc34)n(-c3cccc(O)c3)c(=O)c12

nearest known ligand 0.40

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
PIK3CD O00329 14/20 0.40
PIK3R1 P27986 3/20 0.40
PIK3CG P48736 5/20 0.39
PIK3CB P42338 4/20 0.39
PIK3CA P42336 3/20 0.39
ABL1 P00519 1/20 0.39
SRC P12931 1/20 0.39
MTOR P42345 1/20 0.39
PRKDC P78527 1/20 0.39
ALDH1A1 P00352 1/20 0.38
HSD17B10 Q99714 1/20 0.36
PDE10A Q9Y233 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
SCHEMBL5606889 0.92 PIK3CD (0.41) PIK3CDPIK3R1PIK3CGPIK3CBPIK3CA
SCHEMBL5607928 0.91 PIK3CG (0.41) PIK3CDPIK3R1PIK3CGPIK3CBPIK3CA
SCHEMBL5607754 0.91 PIK3CD (0.48) PIK3CDPIK3R1PIK3CGPIK3CBPIK3CA
SCHEMBL5257938 0.91 PIK3R2 (0.43) PIK3CDPIK3R1
SCHEMBL5607940 0.91 PIK3CD (0.47) PIK3CDPIK3R1PIK3CGPIK3CB
SCHEMBL5258821 0.90 USP2 (0.43) PIK3CDPIK3R1PIK3CG
SCHEMBL5606961 0.88 PIK3CD (0.43) PIK3CDPIK3R1PIK3CGPIK3CBPIK3CA
SCHEMBL5608403 0.88 PIK3CD (0.38) PIK3CDPIK3R1PIK3CGPIK3CBPIK3CA
SCHEMBL5607427 0.88 PIK3CD (0.44) PIK3CDPIK3R1PIK3CGPIK3CBPIK3CA
SCHEMBL5607593 0.87 PIK3CD (0.41) PIK3CDPIK3R1PIK3CGPIK3CBPIK3CA

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 4 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
EP-1750715-A1 METHODS FOR TREATING MAST CELL DISORDERS ICOS CORPORATION (US) 2007-02-14 EP disclosed
WO-2005120511-A1 METHODS FOR TREATING MAST CELL DISORDERS ICOS CORPORATION (US) 2005-12-22 WO disclosed
WO-2005113556-A1 QUINAZOLINONES AS INHIBITORS OF HUMAN PHOSPHATIDYLINOSITOL 3-KINASE DELTA ICOS CORPORATION (US) 2005-12-01 WO disclosed