SCHEMBL31439339

SCHEMBL31439339

Cn1c(=O)n(-c2ccc(C3CNCCN3C(=O)OC(C)(C)C)cc2)c2c3cc(Br)ccc3ncc21

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MTOR P42345 15/20 0.42
▸ PIK3CA P42336 14/20 0.42
▸ PIK3CD O00329 7/20 0.42
▸ PIK3CG P48736 7/20 0.42
▸ PIK3CB P42338 6/20 0.42
▸ PIK3C3 Q8NEB9 2/20 0.42
▸ CSNK2A2 P19784 1/20 0.42
▸ FECH P22830 1/20 0.42
▸ CLK1 P49759 1/20 0.42
▸ GSK3A P49840 1/20 0.42
▸ DYRK1A Q13627 1/20 0.42
▸ MELK Q14680 1/20 0.42
▸ MYLK3 Q32MK0 1/20 0.42
▸ PIP4K2C Q8TBX8 1/20 0.42
▸ TP53RK Q96S44 1/20 0.42
▸ ATM Q13315 8/20 0.39
▸ ATR Q13535 5/20 0.39
▸ RPTOR Q8N122 2/20 0.39
▸ MLST8 Q9BVC4 2/20 0.39
▸ PIK3C2A O00443 2/20 0.39

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
SCHEMBL15747814 0.83 ATM (0.43) MTORPIK3CAPIK3CDPIK3CGPIK3CB
SCHEMBL15747848 0.81 USP30 (0.41) MTORPIK3CAPIK3CDPIK3CGPIK3CB
SCHEMBL27914183 0.77 PIK3CA (0.54) MTORPIK3CAPIK3CDPIK3CGPIK3CB
SCHEMBL28304239 0.77 NR1H2 (0.50) NR1H2NR1H3PARP1
SCHEMBL31439397 0.74 PIK3CA (0.57) MTORPIK3CAPIK3CDPIK3CGPIK3CB
SCHEMBL31439325 0.74 MTOR (0.56) MTORPIK3CAPIK3CDPIK3CGPIK3CB
SCHEMBL5655076 0.74 PIK3CA (0.56) MTORPIK3CAPIK3CDPIK3CGPIK3CB
SCHEMBL15747794 0.73 DDB1 (0.41) MTORPIK3CAPIK3CDATM
SCHEMBL31439345 0.73 PIK3CA (0.53) MTORPIK3CAPIK3CDPIK3CGPIK3CB
SCHEMBL16748243 0.73 MTOR (0.61) MTORPIK3CAATMATRPRKDC

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
CN-119661531-A Imidazolone compound as well as preparation method and application thereof 北京富龙康泰生物技术有限公司 2025-03-21 — — CN disclosed
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