SCHEMBL20839042

SCHEMBL20839042

CC(C)n1c(=O)n(C)c2nnc3ccc(-c4ccc(OCCCN5CCC(F)CC5)nc4)cc3c21

nearest known ligand 0.78

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ ATM Q13315 20/20 0.78
▸ ATR Q13535 5/20 0.78
▸ KCNH2 Q12809 1/20 0.54
▸ MTOR P42345 9/20 0.53
▸ PIK3CA P42336 6/20 0.52

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
SCHEMBL20843825 0.95 ATM (0.79) ATMATRKCNH2MTORPIK3CA
SCHEMBL20839554 0.95 ATM (0.79) ATMATRKCNH2MTORPIK3CA
SCHEMBL20839523 0.91 ATM (0.77) ATMATRKCNH2MTORPIK3CA
SCHEMBL30189177 0.89 ATM (0.68) ATMATRKCNH2MTORPIK3CA
SCHEMBL21911393 0.89 ATM (0.68) ATMATRKCNH2MTORPIK3CA
SCHEMBL19584960 0.88 ATM (1.00) ATMATRKCNH2MTORPIK3CA
SCHEMBL30972010 0.87 ATM (0.60) ATMATRKCNH2MTORPIK3CA
SCHEMBL20839311 0.86 ATM (0.61) ATMATRMTORPIK3CA
SCHEMBL30972080 0.86 ATM (0.58) ATMATRKCNH2MTORPIK3CA
SCHEMBL30971906 0.86 ATM (0.58) ATMATRKCNH2MTORPIK3CA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-111344293-A 1, 3-dihydroimidazo [4, 5-c ] cinnolin-2-one compounds and their use in the treatment of cancer 阿斯利康(瑞典)有限公司 2020-06-26 — — CN claimed
CN-116194109-A Combination of antibody-drug conjugate and ATM inhibitor 阿斯利康(英国)有限公司 2023-05-30 — — CN disclosed
CN-111344293-A 1, 3-dihydroimidazo [4, 5-c ] cinnolin-2-one compounds and their use in the treatment of cancer 阿斯利康(瑞典)有限公司 2020-06-26 — — CN disclosed
WO-2019057757-A1 1,3-DIHYDROIMIDAZO[4,5-C]CINNOLIN-2-ONE COMPOUNDS AND THEIR USE IN TREATING CANCER ASTRAZENECA AB (SE) 2019-03-28 — — WO disclosed
WO-2019057757-A1 1,3-DIHYDROIMIDAZO[4,5-C]CINNOLIN-2-ONE COMPOUNDS AND THEIR USE IN TREATING CANCER ASTRAZENECA AB (SE) 2019-03-28 — — WO disclosed
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