SCHEMBL12992181

SCHEMBL12992181

CCOc1ccc(-c2nc3cc(F)cc(F)c3c(C)c2C)cn1

nearest known ligand 0.40

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
PIK3CA P42336 2/20 0.40
PIK3CD O00329 1/20 0.40
PIK3CB P42338 1/20 0.40
PI4KA P42356 1/20 0.40
PIK3CG P48736 1/20 0.40
PI4KB Q9UBF8 1/20 0.40
CYP19A1 P11511 1/20 0.39
PDE10A Q9Y233 3/20 0.38
GCK P35557 1/20 0.36
SYK P43405 2/20 0.35
DHODH Q02127 2/20 0.34
PTGES O14684 2/20 0.34
ADORA2B P29275 1/20 0.34
FGFR1 P11362 1/20 0.33
FGFR2 P21802 1/20 0.33
KRAS P01116 1/20 0.33
SOS1 Q07889 1/20 0.33
MAPT P10636 1/20 0.33
NAMPT P43490 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
SCHEMBL2712201 0.90 PIK3CA (0.38) PIK3CAPIK3CDPIK3CBPI4KAPIK3CG
SCHEMBL13063909 0.78 APP (0.40) SYKDHODHMAPT
SCHEMBL2711207 0.78 ADORA2B (0.44) PIK3CAPIK3CDPIK3CBPI4KAPIK3CG
SCHEMBL2710885 0.76 PTGES (0.40) PDE10ASYKPTGES
SCHEMBL13063638 0.74 PIK3CA (0.51) PIK3CACYP19A1PDE10AADORA2B
SCHEMBL2713591 0.74 PIK3CD (0.51) PIK3CAPIK3CDMAPT
SCHEMBL2712076 0.73 PIK3CD (0.57) PIK3CAPIK3CD
SCHEMBL13063871 0.72 KCNH2 (0.42) PIK3CA
SCHEMBL2710993 0.72 CYP11B2 (0.35) PIK3CAPIK3CDSYKDHODHADORA2B
SCHEMBL249053 0.72 DHODH (0.37) PIK3CAPIK3CDPIK3CBPI4KAPIK3CG

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-2010151791-A1 HETEROCYCLIC COMPOUNDS AND THEIR USES AMGEN INC. (US) 2010-12-29 WO disclosed