SCHEMBL17397245

SCHEMBL17397245

O=c1c(-c2ccccc2)c(CCNc2ncnc3[nH]cc(F)c23)cc2ccc(F)cn12

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PIK3CD O00329 10/20 0.49
PIK3CB P42338 2/20 0.49
AURKA O14965 4/20 0.40
CDK1 P06493 2/20 0.40
STK3 Q13188 2/20 0.40
CDC7 O00311 1/20 0.40
PLK4 O00444 1/20 0.40
CHUK O15111 1/20 0.40
PDPK1 O15530 1/20 0.40
DYRK3 O43781 1/20 0.40
ROCK2 O75116 1/20 0.40
RPS6KA5 O75582 1/20 0.40
PRKD3 O94806 1/20 0.40
MAP4K4 O95819 1/20 0.40
PRKCG P05129 1/20 0.40
LCK P06239 1/20 0.40
FYN P06241 1/20 0.40
ROS1 P08922 1/20 0.40
FGFR1 P11362 1/20 0.40
PHKG2 P15735 1/20 0.40

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
SCHEMBL17397143 0.90 PIK3CD (0.46) PIK3CDPIK3CBAURKACDK1STK3
SCHEMBL17397290 0.86 PIK3CD (0.53) PIK3CDPIK3CBAURKACDK1PDPK1
SCHEMBL17397151 0.82 PIK3CD (0.54) PIK3CDPIK3CBPIK3CAPIK3R1
SCHEMBL17397286 0.81 PIK3CD (0.50) PIK3CDPIK3CBAURKACDK1STK3
SCHEMBL17397167 0.81 PIK3CD (0.46) PIK3CDPIK3CBAURKAMAP4K4DYRK1A
SCHEMBL17397231 0.80 PIK3CD (0.47) PIK3CDPIK3CBLMNAPOLBPIK3CA
SCHEMBL17397226 0.80 PIK3CD (0.45) PIK3CDPIK3CBAURKAFGFR1LMNA
SCHEMBL17401173 0.79 PIK3CD (0.72) PIK3CDPIK3CBPIK3CAPIK3R1
SCHEMBL17397244 0.79 PIK3CD (0.72) PIK3CDPIK3CBPIK3CAPIK3R1
SCHEMBL17397071 0.79 PIK3CD (0.46) PIK3CDPIK3CBPIK3CA

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