SCHEMBL19006151

SCHEMBL19006151

C[C@H](N)c1c(-c2ccccc2)c(=O)n2cc(F)ccc2c1-c1ccc(O)cc1

nearest known ligand 0.50

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
PIK3CD O00329 17/20 0.50
PIK3CA P42336 8/20 0.50
PIK3CB P42338 4/20 0.50
PIK3CG P48736 2/20 0.50
ESR1 P03372 1/20 0.39
ESR2 Q92731 1/20 0.39
KDM4E B2RXH2 1/20 0.38
ALDH1A1 P00352 1/20 0.38
TDP1 Q9NUW8 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.38
PDE4A P27815 1/20 0.35
PDE4B Q07343 1/20 0.35
PDE4C Q08493 1/20 0.35
PDE4D Q08499 1/20 0.35

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
SCHEMBL19006145 0.93 PIK3CD (0.56) PIK3CDPIK3CAPIK3CBPIK3CGKDM4E
SCHEMBL19006158 0.93 PIK3CD (0.56) PIK3CDPIK3CAPIK3CBPIK3CGKDM4E
SCHEMBL19006157 0.93 PIK3CD (0.56) PIK3CDPIK3CAPIK3CBPIK3CGKDM4E
SCHEMBL19006298 0.93 PIK3CD (0.54) PIK3CDPIK3CAPIK3CBPIK3CGKDM4E
SCHEMBL19006152 0.89 PIK3CD (0.52) PIK3CDPIK3CAPIK3CBPIK3CGKDM4E
SCHEMBL18988837 0.89 PIK3CD (0.52) PIK3CDPIK3CAPIK3CBPIK3CGKDM4E
SCHEMBL18988838 0.89 PIK3CD (0.52) PIK3CDPIK3CAPIK3CBPIK3CGKDM4E
SCHEMBL19006150 0.88 PIK3CD (0.60) PIK3CDPIK3CAPIK3CBPIK3CG
SCHEMBL19006148 0.87 PIK3CD (0.50) PIK3CDPIK3CAPIK3CBPIK3CG
SCHEMBL19006153 0.87 PIK3CD (0.50) PIK3CDPIK3CAPIK3CBPIK3CG

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