SCHEMBL15747787

SCHEMBL15747787

COc1ncc(-c2ccc3ncc4c(c3c2)n(-c2ccc(C3=CCN(C(=O)c5nnc[nH]5)CC3)cc2)c(=O)n4C)cc1C

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MTOR P42345 17/20 0.52
▸ PIK3CA P42336 12/20 0.45
▸ PIK3CD O00329 7/20 0.45
▸ PIK3CB P42338 6/20 0.45
▸ PIK3CG P48736 6/20 0.45
▸ PIK3C2A O00443 2/20 0.43
▸ PIK3C2B O00750 2/20 0.43
▸ PIK3C3 Q8NEB9 2/20 0.41
▸ CSNK2A2 P19784 1/20 0.41
▸ FECH P22830 1/20 0.41
▸ CLK1 P49759 1/20 0.41
▸ GSK3A P49840 1/20 0.41
▸ DYRK1A Q13627 1/20 0.41
▸ MELK Q14680 1/20 0.41
▸ MYLK3 Q32MK0 1/20 0.41
▸ PIP4K2C Q8TBX8 1/20 0.41
▸ TP53RK Q96S44 1/20 0.41
▸ ATM Q13315 9/20 0.40
▸ ATR Q13535 8/20 0.40
▸ CHEK1 O14757 1/20 0.40

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
SCHEMBL15747797 0.85 MTOR (0.50) MTORPIK3CAPIK3CDPIK3CBPIK3CG
SCHEMBL15747788 0.82 MTOR (0.50) MTORPIK3CAPIK3CDPIK3CBPIK3CG
SCHEMBL15747779 0.77 MTOR (0.57) MTORPIK3CAPIK3CDPIK3CBPIK3CG
SCHEMBL15747833 0.76 MTOR (0.55) MTORPIK3CAPIK3CDPIK3CBPIK3CG
SCHEMBL15747826 0.74 MTOR (0.55) MTORPIK3CAPIK3CDPIK3CBPIK3CG
SCHEMBL15747856 0.74 MTOR (0.62) MTORPIK3CAPIK3CDPIK3CBPIK3CG
SCHEMBL15747819 0.74 MTOR (0.61) MTORPIK3CAPIK3CDPIK3CBPIK3CG
SCHEMBL15747828 0.73 MTOR (0.59) MTORPIK3CAPIK3CDPIK3CBPIK3CG
SCHEMBL15747796 0.73 MTOR (0.60) MTORPIK3CAPIK3CDPIK3CBPIK3CG
SCHEMBL15747762 0.72 MTOR (0.59) 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
Send feedback