SCHEMBL15747811

SCHEMBL15747811

COCCOc1ccc(-c2ccc3ncc4c(c3c2)n(-c2ccc(C3CCN(C(=O)OCc5ccccc5)CC3)cc2)c(=O)n4C)cn1

nearest known ligand 0.52

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ ATM Q13315 20/20 0.52
▸ MTOR P42345 14/20 0.52
▸ PIK3CA P42336 13/20 0.52
▸ ATR Q13535 4/20 0.52
▸ PIK3CD O00329 1/20 0.45
▸ PIK3CB P42338 1/20 0.45
▸ PIK3CG P48736 1/20 0.45
▸ PRKDC P78527 1/20 0.45
▸ KCNH2 Q12809 1/20 0.44

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
SCHEMBL15747772 0.89 MTOR (0.55) ATMMTORPIK3CAATRPIK3CD
SCHEMBL15747730 0.88 MTOR (0.55) ATMMTORPIK3CAATRPIK3CD
SCHEMBL15747889 0.86 MTOR (0.47) ATMMTORPIK3CAATRPIK3CD
SCHEMBL15747816 0.86 MTOR (0.55) ATMMTORPIK3CAATRPIK3CD
SCHEMBL15747892 0.86 MTOR (0.56) ATMMTORPIK3CAATRPIK3CD
SCHEMBL15747859 0.86 MTOR (0.50) ATMMTORPIK3CAATRPIK3CD
SCHEMBL15747763 0.86 PIK3CA (0.42) ATMMTORPIK3CAATRPIK3CD
SCHEMBL15747851 0.85 MTOR (0.45) ATMMTORPIK3CAATRPIK3CD
SCHEMBL15747876 0.85 MTOR (0.45) ATMMTORPIK3CAATRPIK3CD
SCHEMBL15747812 0.85 MTOR (0.57) ATMMTORPIK3CAATRPIK3CD

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