SCHEMBL19329284

SCHEMBL19329284

COCc1ccc(-c2ccc3ncc4c(c3c2)n([C@@H]2CCCOC2)c(=O)n4C)c(F)n1

nearest known ligand 0.79

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ ATM Q13315 20/20 0.79
▸ ATR Q13535 4/20 0.79
▸ MTOR P42345 15/20 0.72
▸ PIK3CA P42336 14/20 0.72
▸ KCNH2 Q12809 2/20 0.61

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
SCHEMBL19329285 1.00 ATM (0.79) ATMATRMTORPIK3CAKCNH2
SCHEMBL19329281 0.89 ATM (0.72) ATMATRMTORPIK3CAKCNH2
SCHEMBL19329280 0.89 ATM (0.72) ATMATRMTORPIK3CAKCNH2
SCHEMBL25351294 0.89 ATM (0.72) ATMATRMTORPIK3CAKCNH2
SCHEMBL20006466 0.89 ATM (0.73) ATMATRMTORPIK3CAKCNH2
SCHEMBL17245622 0.89 ATM (0.73) ATMATRMTORPIK3CAKCNH2
SCHEMBL19329261 0.88 ATM (1.00) ATMATRMTORPIK3CAKCNH2
SCHEMBL19346437 0.88 ATM (1.00) ATMATRMTORPIK3CAKCNH2
SCHEMBL19329262 0.88 ATM (1.00) ATMATRMTORPIK3CAKCNH2
SCHEMBL18327213 0.86 ATM (0.81) ATMATRMTORPIK3CAKCNH2

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
WO-2017153578-A1 IMIDAZO[4,5-C]QUINOLIN-2-ONE COMPOUNDS AND THEIR USE IN TREATING CANCER ASTRAZENECA AB (SE) 2017-09-14 — — WO claimed
WO-2017153578-A1 IMIDAZO[4,5-C]QUINOLIN-2-ONE COMPOUNDS AND THEIR USE IN TREATING CANCER ASTRAZENECA AB (SE) 2017-09-14 — — WO disclosed
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