SCHEMBL18824775

SCHEMBL18824775

CN(C)CCCOc1ccc(-c2cc3c(cc2F)nc([C@@H]2CCCOC2)c2c3[nH]c(=O)n2C)cc1

nearest known ligand 0.52

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ ATM Q13315 20/20 0.52
▸ MTOR P42345 14/20 0.52
▸ PIK3CA P42336 11/20 0.52
▸ KCNH2 Q12809 2/20 0.42

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
SCHEMBL17241453 0.92 ATM (0.63) ATMMTORPIK3CAKCNH2
SCHEMBL17241437 0.92 ATM (0.63) ATMMTORPIK3CAKCNH2
SCHEMBL18824627 0.91 ATM (0.51) ATMMTORPIK3CAKCNH2
SCHEMBL18824924 0.89 ATM (0.59) ATMMTORPIK3CAKCNH2
SCHEMBL17241457 0.88 ATM (0.62) ATMMTORPIK3CAKCNH2
SCHEMBL18824763 0.88 ATM (0.47) ATMMTORPIK3CAKCNH2
SCHEMBL18824583 0.85 ATM (0.54) ATMMTORPIK3CAKCNH2
SCHEMBL17241468 0.84 ATM (0.62) ATMMTORPIK3CA
SCHEMBL17241494 0.84 ATM (0.62) ATMMTORPIK3CAKCNH2
SCHEMBL17241779 0.84 ATM (0.62) ATMMTORPIK3CAKCNH2

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-3371183-A1 IMIDAZO[4,5-C]QUINOLIN-2-ONE COMPOUNDS AND THEIR USE IN TREATING CANCER Astrazeneca AB (SE) 2018-09-12 — — EP disclosed
WO-2017076895-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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