SCHEMBL17397167

SCHEMBL17397167

O=c1c(-c2ccccc2)c(CCNc2ncnc3cccnc23)cc2ccc(F)cn12

nearest known ligand 0.46

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
PIK3CD O00329 11/20 0.46
PIK3CB P42338 2/20 0.46
EGFR P00533 2/20 0.41
PIK3CA P42336 2/20 0.36
LMNA P02545 2/20 0.35
POLB P06746 1/20 0.35
MAP4K4 O95819 3/20 0.35
DYRK1A Q13627 1/20 0.34
HTT P42858 2/20 0.33
AURKA O14965 1/20 0.33
APP P05067 1/20 0.33
MAPK1 P28482 1/20 0.33

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
SCHEMBL17397290 0.84 PIK3CD (0.53) PIK3CDPIK3CBPIK3CALMNAPOLB
SCHEMBL17397226 0.83 PIK3CD (0.45) PIK3CDPIK3CBPIK3CALMNAPOLB
SCHEMBL17397245 0.81 PIK3CD (0.49) PIK3CDPIK3CBPIK3CALMNAPOLB
SCHEMBL17397151 0.80 PIK3CD (0.54) PIK3CDPIK3CBPIK3CA
SCHEMBL17397286 0.79 PIK3CD (0.50) PIK3CDPIK3CBPIK3CALMNAPOLB
SCHEMBL17401133 0.79 PIK3CD (0.67) PIK3CDPIK3CBPIK3CA
SCHEMBL17397165 0.79 PIK3CD (0.67) PIK3CDPIK3CBPIK3CA
SCHEMBL17397231 0.79 PIK3CD (0.47) PIK3CDPIK3CBPIK3CALMNAPOLB
SCHEMBL17397252 0.78 PIK3CD (0.44) PIK3CDPIK3CBPIK3CA
SCHEMBL17397143 0.77 PIK3CD (0.46) PIK3CDPIK3CBPIK3CALMNAPOLB

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