SCHEMBL19006283

SCHEMBL19006283

C[C@H](Nc1ncnc(N)c1C#N)c1c(-c2ccccc2)c(=O)n2cc(F)ccc2c1-c1cccc(F)c1

nearest known ligand 0.75

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
PIK3CD O00329 20/20 0.75
PIK3CA P42336 8/20 0.73
PIK3CG P48736 5/20 0.71
PIK3CB P42338 5/20 0.71
PIK3R1 P27986 1/20 0.57

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
SCHEMBL18988930 0.96 PIK3CD (0.79) PIK3CDPIK3CAPIK3CGPIK3CBPIK3R1
SCHEMBL18988932 0.96 PIK3CD (0.79) PIK3CDPIK3CAPIK3CGPIK3CBPIK3R1
SCHEMBL19006240 0.95 PIK3CD (0.73) PIK3CDPIK3CAPIK3CGPIK3CBPIK3R1
SCHEMBL19006311 0.94 PIK3CD (0.82) PIK3CDPIK3CAPIK3CGPIK3CBPIK3R1
SCHEMBL19006307 0.94 PIK3CD (0.82) PIK3CDPIK3CAPIK3CGPIK3CBPIK3R1
SCHEMBL19006170 0.94 PIK3CD (0.82) PIK3CDPIK3CAPIK3CGPIK3CBPIK3R1
SCHEMBL19006241 0.92 PIK3CD (0.79) PIK3CDPIK3CAPIK3CGPIK3CBPIK3R1
SCHEMBL19006290 0.92 PIK3CD (0.76) PIK3CDPIK3CAPIK3CGPIK3CBPIK3R1
SCHEMBL19006281 0.91 PIK3CD (0.75) PIK3CDPIK3CAPIK3CGPIK3CBPIK3R1
SCHEMBL18988868 0.91 PIK3CD (0.74) PIK3CDPIK3CAPIK3CGPIK3CBPIK3R1

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-2017103825-A1 QUINOLIZINONE DERIVATIVES AS PI3K INHIBITORS LUPIN LIMITED (IN) 2017-06-22 WO disclosed