SCHEMBL18844626

SCHEMBL18844626

CN(C)CCCOc1ccc(-c2ccc3ncc4c(c3c2)n(C2CCCC2)c(=O)n4C)cc1

nearest known ligand 0.83

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ ATM Q13315 19/20 0.83
▸ ATR Q13535 3/20 0.79
▸ PIK3CA P42336 15/20 0.79
▸ MTOR P42345 15/20 0.70
▸ PIK3CD O00329 1/20 0.70
▸ PIK3CB P42338 1/20 0.70
▸ PIK3CG P48736 1/20 0.70
▸ PRKDC P78527 1/20 0.70
▸ KCNH2 Q12809 1/20 0.69

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
SCHEMBL18824758 0.94 ATM (0.77) ATMATRPIK3CAMTORPIK3CD
SCHEMBL18824768 0.92 ATM (0.82) ATMATRPIK3CAMTORPIK3CD
SCHEMBL20550164 0.92 ATM (0.91) ATMATRPIK3CAMTORPIK3CD
SCHEMBL18844684 0.92 ATM (0.91) ATMATRPIK3CAMTORPIK3CD
SCHEMBL18844683 0.92 ATM (0.91) ATMATRPIK3CAMTORPIK3CD
SCHEMBL18824545 0.91 ATM (1.00) ATMATRPIK3CAMTORPIK3CD
SCHEMBL18824912 0.91 ATM (1.00) ATMATRPIK3CAMTORPIK3CD
SCHEMBL18824921 0.90 ATM (0.91) ATMATRPIK3CAMTORKCNH2
SCHEMBL18844682 0.90 ATM (0.91) ATMATRPIK3CAMTORKCNH2
SCHEMBL18824925 0.90 ATM (0.91) ATMATRPIK3CAMTORKCNH2

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-2017076895-A1 IMIDAZO[4,5-C]QUINOLIN-2-ONE COMPOUNDS AND THEIR USE IN TREATING CANCER ASTRAZENECA AB (SE) 2017-05-11 — — WO disclosed
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