SCHEMBL15747810

SCHEMBL15747810

Cn1cc(-c2ccc(-c3ccc4ncc5c(c4c3)n(-c3ccc(C4CCCNC4)cc3)c(=O)n5C)cn2)cn1

nearest known ligand 0.59

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ MTOR P42345 20/20 0.59
▸ PIK3CA P42336 6/20 0.54
▸ PIK3CD O00329 4/20 0.54
▸ PIK3CB P42338 4/20 0.54
▸ PIK3CG P48736 4/20 0.54
▸ ATM Q13315 1/20 0.45
▸ ATR Q13535 1/20 0.45
▸ CSNK2A2 P19784 1/20 0.45
▸ FECH P22830 1/20 0.45
▸ CLK1 P49759 1/20 0.45
▸ GSK3A P49840 1/20 0.45
▸ DYRK1A Q13627 1/20 0.45
▸ MELK Q14680 1/20 0.45
▸ MYLK3 Q32MK0 1/20 0.45
▸ PIK3C3 Q8NEB9 1/20 0.45
▸ PIP4K2C Q8TBX8 1/20 0.45
▸ TP53RK Q96S44 1/20 0.45

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
SCHEMBL15747791 0.92 MTOR (0.61) MTORPIK3CAPIK3CDPIK3CBPIK3CG
SCHEMBL15747847 0.87 MTOR (0.69) MTORPIK3CAPIK3CDPIK3CBPIK3CG
SCHEMBL15747752 0.86 MTOR (0.69) MTORPIK3CAPIK3CDPIK3CBPIK3CG
SCHEMBL15747878 0.85 MTOR (0.71) MTORPIK3CAPIK3CDPIK3CBPIK3CG
SCHEMBL16748363 0.85 MTOR (0.72) MTORPIK3CAATMATR
SCHEMBL16748265 0.85 MTOR (0.72) MTORPIK3CAATMATR
SCHEMBL31439341 0.85 MTOR (0.60) MTORPIK3CAPIK3CDPIK3CBPIK3CG
SCHEMBL15747877 0.84 MTOR (0.77) MTORPIK3CAPIK3CDPIK3CBPIK3CG
SCHEMBL15747862 0.84 MTOR (0.78) MTORPIK3CAPIK3CDPIK3CBPIK3CG
SCHEMBL31439313 0.83 MTOR (0.64) MTORPIK3CAPIK3CDPIK3CBPIK3CG

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-2014079364-A1 IMIDAZOLONE DERIVATIVES, PHARMACEUTICAL COMPOSITIONS AND USES THEREOF 北京富龙康泰生物技术有限公司 (CN) 2014-05-30 — — WO disclosed
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