SCHEMBL17241367

SCHEMBL17241367

Cn1c(=O)[nH]c2c3cc(-c4ccc(F)nc4)c(F)cc3nc([C@@H]3CCCOC3)c21

nearest known ligand 0.43

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ ATM Q13315 19/20 0.43
▸ MTOR P42345 6/20 0.43
▸ PIK3CA P42336 4/20 0.43
▸ KCNH2 Q12809 7/20 0.43
▸ ATR Q13535 2/20 0.36

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
SCHEMBL17241384 0.90 ATM (0.45) ATMMTORPIK3CAKCNH2ATR
SCHEMBL18824809 0.86 ATM (0.53) ATMMTORPIK3CAKCNH2ATR
SCHEMBL17241453 0.86 ATM (0.63) ATMMTORPIK3CAKCNH2ATR
SCHEMBL17241437 0.86 ATM (0.63) ATMMTORPIK3CAKCNH2ATR
SCHEMBL17241650 0.85 ATM (0.63) ATMMTORPIK3CAKCNH2ATR
SCHEMBL18824744 0.85 ATM (0.49) ATMMTORPIK3CAATR
SCHEMBL18824775 0.83 ATM (0.52) ATMMTORPIK3CAKCNH2
SCHEMBL18824621 0.82 TLR7 (0.32) ATMMTORPIK3CAKCNH2
SCHEMBL17241477 0.82 TLR7 (0.32) ATMMTORPIK3CAKCNH2
SCHEMBL17241732 0.82 ATM (0.41) 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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3140303-A1 IMIDAZO[4,5-C]QUINOLIN-2-ONE COMPOUNDS AND THEIR USE IN TREATING CANCER Astrazeneca AB (SE) 2017-03-15 — — EP disclosed
WO-2015170081-A1 IMIDAZO[4,5-C]QUINOLIN-2-ONE COMPOUNDS AND THEIR USE IN TREATING CANCER ASTRAZENECA AB (SE) 2015-11-12 — — WO disclosed
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