SCHEMBL16628970

SCHEMBL16628970

C[C@H](NC(=O)c1c(N)nn2cccnc12)c1nc2cc(Cl)ccc2c(=O)n1-c1ccccc1

nearest known ligand 0.90

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
PIK3CD O00329 20/20 0.90
PIK3CG P48736 20/20 0.90
PIK3R2 O00459 9/20 0.90
PIK3CA P42336 9/20 0.68
PIK3CB P42338 9/20 0.68
PIK3R1 P27986 2/20 0.64

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
SCHEMBL16628965 0.94 PIK3CG (1.00) PIK3CDPIK3CGPIK3R2PIK3CAPIK3CB
SCHEMBL16628977 0.91 PIK3CD (1.00) PIK3CDPIK3CGPIK3R2PIK3CAPIK3CB
SCHEMBL17987923 0.87 PIK3CG (0.83) PIK3CDPIK3CGPIK3R2PIK3CAPIK3CB
SCHEMBL17987925 0.86 PIK3CG (0.83) PIK3CDPIK3CGPIK3R2PIK3CAPIK3CB
SCHEMBL16628971 0.85 PIK3CD (1.00) PIK3CDPIK3CGPIK3R2PIK3CAPIK3CB
SCHEMBL15306912 0.85 PIK3CD (0.87) PIK3CDPIK3CGPIK3R2PIK3CAPIK3CB
SCHEMBL16619187 0.85 PIK3CD (0.87) PIK3CDPIK3CGPIK3R2PIK3CAPIK3CB
SCHEMBL16630042 0.83 PIK3CD (0.82) PIK3CDPIK3CGPIK3R2PIK3CAPIK3CB
SCHEMBL16630196 0.83 PIK3CD (0.82) PIK3CDPIK3CGPIK3R2PIK3CAPIK3CB
SCHEMBL16630449 0.83 PIK3CD (0.82) PIK3CDPIK3CGPIK3R2PIK3CAPIK3CB

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-2015051241-A1 HETEROCYCLIC COMPOUNDS AND USES THEREOF INFINITY PHARMACEUTICALS, INC. (US) 2015-04-09 WO disclosed