SCHEMBL17397157

SCHEMBL17397157

Cc1c(F)ccc2cc(CCNc3ncnc4[nH]cnc34)c(-c3ccccc3)c(=O)n12

nearest known ligand 0.47

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
PIK3CD O00329 16/20 0.47
PIK3CB P42338 4/20 0.40
PIK3CA P42336 1/20 0.40
MAPK1 P28482 2/20 0.34
HTT P42858 2/20 0.34
TAAR1 Q96RJ0 1/20 0.34
MERTK Q12866 1/20 0.32
PIK3R1 P27986 1/20 0.32
AXL P30530 1/20 0.32
PIK3CG P48736 1/20 0.32
AURKA O14965 1/20 0.32
LMNA P02545 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32

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
SCHEMBL17397103 0.87 PIK3CD (0.53) PIK3CDPIK3CBPIK3CAMAPK1HTT
SCHEMBL17397279 0.83 PIK3CD (0.44) PIK3CDPIK3CBPIK3CAMAPK1HTT
SCHEMBL17397290 0.83 PIK3CD (0.53) PIK3CDPIK3CBPIK3CAMAPK1HTT
SCHEMBL17397178 0.82 PIK3CD (0.68) PIK3CDPIK3CBPIK3CAPIK3R1PIK3CG
SCHEMBL17397141 0.82 PIK3CD (0.52) PIK3CDPIK3CBPIK3CAMERTKPIK3R1
SCHEMBL17397303 0.81 PIK3CD (0.51) PIK3CDPIK3CBPIK3CAMAPK1HTT
SCHEMBL17401076 0.80 PIK3CD (0.70) PIK3CDPIK3CBPIK3CAMERTKPIK3R1
SCHEMBL17401150 0.80 PIK3CD (0.70) PIK3CDPIK3CBPIK3CAMERTKPIK3R1
SCHEMBL17397155 0.80 PIK3CD (0.70) PIK3CDPIK3CBPIK3CAMERTKPIK3R1
SCHEMBL17397140 0.79 PIK3CD (0.46) PIK3CDPIK3CBPIK3CAMERTKPIK3R1

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