SCHEMBL19006161

SCHEMBL19006161

NCc1c(-c2ccccc2)c(=O)n2cc(F)ccc2c1C1CC1

nearest known ligand 0.48

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
PIK3CD O00329 12/20 0.48
PIK3CA P42336 6/20 0.48
FABP4 P15090 1/20 0.37
PIK3CB P42338 2/20 0.36
PIK3CG P48736 2/20 0.36
CYP11B1 P15538 2/20 0.34
CYP11B2 P19099 2/20 0.34
DPP4 P27487 2/20 0.34
PRKAA2 P54646 1/20 0.33
CNR2 P34972 1/20 0.32
ABHD6 Q9BV23 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
SCHEMBL18988624 0.91 PIK3CD (0.47) PIK3CDPIK3CAFABP4PIK3CBPIK3CG
SCHEMBL19006273 0.91 PIK3CD (0.41) PIK3CDPIK3CAFABP4CYP11B1CYP11B2
SCHEMBL18988560 0.84 PIK3CD (0.44) PIK3CDPIK3CAPIK3CBPIK3CGDPP4
SCHEMBL18988459 0.82 PIK3CD (0.40) PIK3CDPIK3CA
SCHEMBL19006315 0.81 PIK3CD (0.46) PIK3CDPIK3CAPIK3CBPIK3CGDPP4
SCHEMBL19006159 0.80 PIK3CD (0.59) PIK3CDPIK3CAPIK3CBPIK3CGCYP11B1
SCHEMBL18989298 0.75 PIK3CD (0.43) PIK3CDPIK3CAPIK3CBPIK3CGDPP4
SCHEMBL18988694 0.74 PIK3CD (0.59) PIK3CDPIK3CAPIK3CBPIK3CG
SCHEMBL19006198 0.74 PIK3CD (0.55) PIK3CDPIK3CAPIK3CBPIK3CG
SCHEMBL18988763 0.74 PIK3CD (0.44) PIK3CDPIK3CAPIK3CBPIK3CGDPP4

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