SCHEMBL17397197

SCHEMBL17397197

O=c1c(-c2cccc(F)c2)c(CCNc2ncnc3[nH]cnc23)cc2ccccn12

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PIK3CD O00329 16/20 0.44
PIK3CB P42338 2/20 0.39
PIK3CG P48736 2/20 0.39
MAP4K4 O95819 3/20 0.38
MERTK Q12866 1/20 0.37
PIK3R1 P27986 1/20 0.37
AXL P30530 1/20 0.37
AURKA O14965 1/20 0.36
DAPK3 O43293 1/20 0.36
JAK2 O60674 1/20 0.36
PRKD3 O94806 1/20 0.36
PAK4 O96013 1/20 0.36
ABL1 P00519 1/20 0.36
LCK P06239 1/20 0.36
CSF1R P07333 1/20 0.36
RET P07949 1/20 0.36
PDGFRB P09619 1/20 0.36
FGFR1 P11362 1/20 0.36
PRKACA P17612 1/20 0.36
FLT1 P17948 1/20 0.36

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
SCHEMBL17397303 0.91 PIK3CD (0.51) PIK3CDPIK3CBAURKABTK
SCHEMBL17397141 0.86 PIK3CD (0.52) PIK3CDPIK3CBPIK3CGMAP4K4MERTK
SCHEMBL17397180 0.85 PIK3CD (0.43) PIK3CDPIK3CBPIK3CGMAP4K4MERTK
SCHEMBL17397290 0.84 PIK3CD (0.53) PIK3CDPIK3CBAURKA
SCHEMBL17397114 0.82 PIK3CD (0.57) PIK3CDPIK3CBPIK3CG
SCHEMBL17397252 0.82 PIK3CD (0.44) PIK3CDPIK3CB
SCHEMBL17331673 0.81 MAP4K4 (0.42) PIK3CDPIK3CGMAP4K4AURKADAPK3
SCHEMBL17397231 0.81 PIK3CD (0.47) PIK3CDPIK3CB
SCHEMBL17397286 0.80 PIK3CD (0.50) PIK3CDPIK3CBMAP4K4AXLAURKA
SCHEMBL17397196 0.80 PIK3CD (0.65) PIK3CDPIK3CBPIK3CGMERTKPIK3R1

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-3164400-A1 QUINOLIZINONE DERIVATIVES AS PI3K INHIBITORS Lupin Limited (IN) 2017-05-10 EP claimed
WO-2016001855-A1 QUINOLIZINONE DERIVATIVES AS PI3K INHIBITORS LUPIN LIMITED (IN) 2016-01-07 WO claimed
EP-3164400-A1 QUINOLIZINONE DERIVATIVES AS PI3K INHIBITORS Lupin Limited (IN) 2017-05-10 EP disclosed
WO-2016001855-A1 QUINOLIZINONE DERIVATIVES AS PI3K INHIBITORS LUPIN LIMITED (IN) 2016-01-07 WO disclosed