SCHEMBL18824950

SCHEMBL18824950

CN(C)C1CCN(c2ccc(-c3ccc4nc(C5CCOCC5)c5c([nH]c(=O)n5C)c4c3)cn2)CC1

nearest known ligand 0.48

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ ATM Q13315 5/20 0.48
▸ ATR Q13535 3/20 0.48
▸ PIK3CA P42336 2/20 0.48
▸ MTOR P42345 2/20 0.48
▸ TLR9 Q9NR96 1/20 0.45
▸ TLR8 Q9NR97 1/20 0.45
▸ TLR7 Q9NYK1 1/20 0.45
▸ EZH2 Q15910 3/20 0.40
▸ MCHR1 Q99705 11/20 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
SCHEMBL18824749 0.93 ATM (0.50) ATMATRPIK3CAMTORTLR9
SCHEMBL18824740 0.86 ATM (0.46) ATMATRPIK3CAMTORTLR9
SCHEMBL18824743 0.86 ATM (0.46) ATMATRPIK3CAMTORTLR9
SCHEMBL18824981 0.85 ATM (0.45) ATMATRPIK3CAMTORTLR9
SCHEMBL18824979 0.85 ATM (0.45) ATMATRPIK3CAMTORTLR9
SCHEMBL17241436 0.83 ATM (0.41) ATMATRPIK3CAMTOR
SCHEMBL18824809 0.81 ATM (0.53) ATMATRPIK3CAMTORTLR9
SCHEMBL18824989 0.79 ATM (0.61) ATMATRPIK3CAMTORTLR9
SCHEMBL17241432 0.79 ATM (0.61) ATMATRPIK3CAMTOR
SCHEMBL18824692 0.78 ATM (0.48) ATMATRPIK3CAMTOR

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3370722-A1 IMIDAZO[4,5-C]QUINOLIN-2-ONE COMPOUNDS AND THEIR USE IN TREATING CANCER Astrazeneca AB (SE) 2018-09-12 — — EP disclosed
WO-2017076898-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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