SCHEMBL18824809

SCHEMBL18824809

CN(C)C1CCN(c2ccc(-c3cc4c(cc3F)nc([C@H]3CCCOC3)c3c4[nH]c(=O)n3C)cn2)CC1

nearest known ligand 0.53

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ ATM Q13315 11/20 0.53
▸ MTOR P42345 5/20 0.41
▸ PIK3CA P42336 4/20 0.41
▸ WDR5 P61964 1/20 0.40
▸ KCNH2 Q12809 2/20 0.39
▸ MCHR1 Q99705 7/20 0.38
▸ ATR Q13535 2/20 0.38
▸ TLR9 Q9NR96 1/20 0.37
▸ TLR8 Q9NR97 1/20 0.37
▸ TLR7 Q9NYK1 1/20 0.37

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
SCHEMBL18824744 0.96 ATM (0.49) ATMMTORPIK3CAWDR5MCHR1
SCHEMBL17241367 0.86 ATM (0.43) ATMMTORPIK3CAKCNH2ATR
SCHEMBL18824753 0.83 ATM (0.63) ATMMTORPIK3CAWDR5MCHR1
SCHEMBL17241453 0.82 ATM (0.63) ATMMTORPIK3CAKCNH2ATR
SCHEMBL17241437 0.82 ATM (0.63) ATMMTORPIK3CAKCNH2ATR
SCHEMBL18824749 0.81 ATM (0.50) ATMMTORPIK3CAMCHR1ATR
SCHEMBL18824950 0.81 ATM (0.48) ATMMTORPIK3CAMCHR1ATR
SCHEMBL18824775 0.80 ATM (0.52) ATMMTORPIK3CAKCNH2
SCHEMBL17241650 0.80 ATM (0.63) ATMMTORPIK3CAKCNH2ATR
SCHEMBL18824901 0.77 ATM (0.69) ATMMTORPIK3CAKCNH2ATR

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 4 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 claimed
WO-2017076898-A1 IMIDAZO[4,5-C]QUINOLIN-2-ONE COMPOUNDS AND THEIR USE IN TREATING CANCER ASTRAZENECA AB (SE) 2017-05-11 — — WO claimed
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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