SCHEMBL19006271

SCHEMBL19006271

C[C@H](N)c1c(-c2cccc(F)c2)c(=O)n2cc(F)ccc2c1C1CC1

nearest known ligand 0.51

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
PIK3CD O00329 15/20 0.51
PIK3CA P42336 6/20 0.51
PIK3CB P42338 2/20 0.38
PIK3CG P48736 2/20 0.38
PGR P06401 1/20 0.35
PDE4A P27815 1/20 0.34
CYP1A2 P05177 1/20 0.33
CYP3A4 P08684 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
SCHEMBL19006159 0.91 PIK3CD (0.59) PIK3CDPIK3CAPIK3CBPIK3CG
SCHEMBL19006155 0.89 PIK3CD (0.52) PIK3CDPIK3CAPIK3CBPIK3CG
SCHEMBL19006148 0.83 PIK3CD (0.50) PIK3CDPIK3CAPIK3CBPIK3CG
SCHEMBL19006273 0.81 PIK3CD (0.41) PIK3CDPIK3CAPDE4ACYP1A2CYP3A4
SCHEMBL18988459 0.79 PIK3CD (0.40) PIK3CDPIK3CAPDE4ACYP1A2CYP3A4
SCHEMBL19006243 0.77 PIK3CD (0.78) PIK3CDPIK3CAPIK3CBPIK3CG
SCHEMBL19006298 0.77 PIK3CD (0.54) PIK3CDPIK3CAPIK3CBPIK3CG
SCHEMBL18988603 0.77 PIK3CD (0.71) PIK3CDPIK3CAPIK3CBPIK3CG
SCHEMBL19006316 0.77 PIK3CD (0.89) PIK3CDPIK3CAPIK3CBPIK3CG
SCHEMBL19006153 0.77 PIK3CD (0.50) PIK3CDPIK3CAPIK3CBPIK3CG

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