SCHEMBL17241559

SCHEMBL17241559

Cn1c(=O)[nH]c2c3cc(-c4ccc(OCCCN5CCCCC5)nc4)ccc3nc([C@@H]3CCOC3)c21

nearest known ligand 0.61

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ ATM Q13315 20/20 0.61
▸ MTOR P42345 17/20 0.61
▸ PIK3CA P42336 11/20 0.61
▸ ATR Q13535 5/20 0.57
▸ KCNH2 Q12809 1/20 0.49

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
SCHEMBL17241387 0.94 ATM (0.61) ATMMTORPIK3CAATRKCNH2
SCHEMBL17241465 0.91 ATM (0.60) ATMMTORPIK3CAATRKCNH2
SCHEMBL17241434 0.88 ATM (0.60) ATMMTORPIK3CAATRKCNH2
SCHEMBL17241650 0.86 ATM (0.63) ATMMTORPIK3CAATRKCNH2
Trifluoroacetic Acid SCHEMBL17241751 0.86 ATM (0.56) ATMMTORPIK3CAATRKCNH2
SCHEMBL17241426 0.85 MTOR (0.61) ATMMTORPIK3CAATRKCNH2
SCHEMBL17241726 0.85 ATM (0.61) ATMMTORPIK3CAATRKCNH2
SCHEMBL17241430 0.85 ATM (0.64) ATMMTORPIK3CAATRKCNH2
SCHEMBL17241466 0.84 ATM (0.61) ATMMTORPIK3CAATRKCNH2
SCHEMBL17241432 0.84 ATM (0.61) ATMMTORPIK3CAATRKCNH2

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