SCHEMBL23615854

SCHEMBL23615854

CN1C(=O)C2(CCOCC2)c2c1cnc1ccc(-c3ccc(OCCCN4CCCC4)nc3)cc21

nearest known ligand 0.57

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ ATM Q13315 20/20 0.57
▸ MTOR P42345 18/20 0.57
▸ PIK3CA P42336 12/20 0.57
▸ 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
SCHEMBL21851127 0.99 ATM (0.57) ATMMTORPIK3CAATRKCNH2
SCHEMBL29968726 0.93 ATM (0.53) ATMMTORPIK3CAATR
SCHEMBL21851099 0.93 ATM (0.56) ATMMTORPIK3CAATR
SCHEMBL21851164 0.89 ATM (0.54) ATMMTORPIK3CAATRKCNH2
SCHEMBL21851017 0.89 ATM (0.57) ATMMTORPIK3CAATR
SCHEMBL21850966 0.89 ATM (0.57) ATMMTORPIK3CAATR
SCHEMBL21851020 0.89 ATM (0.57) ATMMTORPIK3CAATR
SCHEMBL21851215 0.89 ATM (0.53) ATMMTORPIK3CAATRKCNH2
SCHEMBL21851218 0.88 MTOR (0.58) ATMMTORPIK3CAATRKCNH2
SCHEMBL21851043 0.88 ATM (0.58) 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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3845532-B1 QUINOLINO-PYRROLIDIN-2-ONE DERIVATIVE AND APPLICATION THEREOF MEDSHINE DISCOVERY INC (CN) 2022-12-21 — — EP disclosed
EP-3845532-A1 QUINOLINO-PYRROLIDIN-2-ONE DERIVATIVE AND APPLICATION THEREOF Medshine Discovery Inc. (CN) 2021-07-07 — — EP disclosed
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