SCHEMBL19006145

SCHEMBL19006145

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

nearest known ligand 0.56

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
PIK3CD O00329 17/20 0.56
PIK3CA P42336 8/20 0.56
PIK3CB P42338 4/20 0.56
PIK3CG P48736 2/20 0.56
KDM4E B2RXH2 1/20 0.39
ALDH1A1 P00352 1/20 0.39
TDP1 Q9NUW8 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.39
MAPK14 Q16539 1/20 0.37

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
SCHEMBL19006157 1.00 PIK3CD (0.56) PIK3CDPIK3CAPIK3CBPIK3CGKDM4E
SCHEMBL19006158 1.00 PIK3CD (0.56) PIK3CDPIK3CAPIK3CBPIK3CGKDM4E
SCHEMBL19006298 0.97 PIK3CD (0.54) PIK3CDPIK3CAPIK3CBPIK3CGKDM4E
SCHEMBL19006152 0.94 PIK3CD (0.52) PIK3CDPIK3CAPIK3CBPIK3CGKDM4E
SCHEMBL19006151 0.93 PIK3CD (0.50) PIK3CDPIK3CAPIK3CBPIK3CGKDM4E
SCHEMBL19006148 0.91 PIK3CD (0.50) PIK3CDPIK3CAPIK3CBPIK3CG
SCHEMBL19006153 0.91 PIK3CD (0.50) PIK3CDPIK3CAPIK3CBPIK3CG
SCHEMBL19006154 0.91 PIK3CD (0.59) PIK3CDPIK3CAPIK3CBPIK3CGKDM4E
SCHEMBL18988838 0.91 PIK3CD (0.52) PIK3CDPIK3CAPIK3CBPIK3CGKDM4E
SCHEMBL18988837 0.91 PIK3CD (0.52) PIK3CDPIK3CAPIK3CBPIK3CGKDM4E

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