SCHEMBL19006155

SCHEMBL19006155

C[C@H](N)c1c(-c2ccc(F)cc2)c(=O)n2cc(F)ccc2c1C1CC1

nearest known ligand 0.52

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
PIK3CD O00329 11/20 0.52
PIK3CA P42336 7/20 0.52
PIK3CB P42338 2/20 0.42
PIK3CG P48736 2/20 0.42
PTGS1 P23219 3/20 0.34
PTGS2 P35354 3/20 0.34
DPP4 P27487 1/20 0.33
KCNH2 Q12809 1/20 0.33
DPP8 Q6V1X1 1/20 0.33
DPP9 Q86TI2 1/20 0.33
DPP7 Q9UHL4 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 0.93 PIK3CD (0.59) PIK3CDPIK3CAPIK3CBPIK3CG
SCHEMBL19006271 0.89 PIK3CD (0.51) PIK3CDPIK3CAPIK3CBPIK3CG
SCHEMBL19006157 0.81 PIK3CD (0.56) PIK3CDPIK3CAPIK3CBPIK3CG
SCHEMBL19006158 0.81 PIK3CD (0.56) PIK3CDPIK3CAPIK3CBPIK3CG
SCHEMBL19006145 0.81 PIK3CD (0.56) PIK3CDPIK3CAPIK3CBPIK3CG
SCHEMBL19006156 0.79 PIK3CD (0.45) PIK3CDPIK3CAPIK3CBPIK3CGPTGS1
SCHEMBL19006298 0.78 PIK3CD (0.54) PIK3CDPIK3CAPIK3CBPIK3CG
SCHEMBL18988560 0.77 PIK3CD (0.44) PIK3CDPIK3CAPIK3CBPIK3CGPTGS1
SCHEMBL19006152 0.75 PIK3CD (0.52) PIK3CDPIK3CAPIK3CBPIK3CG
SCHEMBL19006274 0.75 PIK3CD (0.56) 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