Donepezil

Donepezil

SCHEMBL4256889

COc1cc2c(cc1OC)C(=O)C(CC1CCN(Cc3ccccc3)CC1)C2.Cl.Cl

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

ACHE

The experimentally established mechanism targets of Donepezil. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ACHE known ✓ P22303 5/20 1.00
BCHE P06276 5/20 1.00
KDM4E B2RXH2 1/20 1.00
FAAH O00519 1/20 0.98
ABCC4 O15439 1/20 0.98
CACNA1F O60840 1/20 0.98
PDE5A O76074 1/20 0.98
ABCB11 O95342 1/20 0.98
APP P05067 1/20 0.98
CHRM2 P08172 1/20 0.98
ABCB1 P08183 1/20 0.98
CYP3A4 P08684 1/20 0.98
CHRM5 P08912 1/20 0.98
ADRA2A P08913 1/20 0.98
CHRM1 P11229 1/20 0.98
ADRA2C P18825 1/20 0.98
DRD4 P21917 1/20 0.98
SLC6A2 P23975 1/20 0.98
MAOB P27338 1/20 0.98
AGTR1 P30556 1/20 0.98

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
Donepezil SCHEMBL3091472 1.00 BCHE (1.00) BCHEACHEKDM4EFAAHABCC4
Donepezil SCHEMBL29424585 1.00 BCHE (1.00) BCHEACHEKDM4EFAAHABCC4
Donepezil SCHEMBL5060933 1.00 BCHE (1.00) BCHEACHEKDM4EFAAHABCC4
Donepezil SCHEMBL1815 1.00 BCHE (1.00) BCHEACHEKDM4EFAAHABCC4
Donepezil SCHEMBL1559622 1.00 BCHE (1.00) BCHEACHEKDM4EFAAHABCC4
Donepezil SCHEMBL1123745 0.99 BCHE (1.00) BCHEACHEKDM4EFAAHABCC4
Donepezil SCHEMBL4312618 0.99 BCHE (1.00) BCHEACHEKDM4EFAAHABCC4
Donepezil SCHEMBL4315806 0.99 BCHE (1.00) BCHEACHEKDM4EFAAHABCC4
Donepezil SCHEMBL8265876 0.99 BCHE (1.00) BCHEACHEKDM4EFAAHABCC4
Donepezil SCHEMBL3851203 0.99 BCHE (1.00) BCHEACHEKDM4EFAAHABCC4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2098232-B1 PERCUTANEOUS ABSORPTION PREPARATION NITTO DENKO CORP (JP) 2013-06-05 EP disclosed
EP-2098232-A1 PERCUTANEOUS ABSORPTION PREPARATION NITTO DENKO CORPORATION (JP) 2009-09-09 EP disclosed
US-20080131491-A1 Percutaneously absorbable preparation EISAI R & D MANAGEMENT CO., LTD. (JP) 2008-06-05 US disclosed
EP-0742207-A1 2-(Indan-1-one-2-yl-alkyl)-1-phenylalkyl-piperidines and processes for their preparation Eisai Co., Ltd. (JP) 1996-11-13 EP disclosed
EP-0579263-A1 1,4-Substituted piperidines as acetylchozinesterase inhibitors and their use for the treatment of Alzheimer's disease Eisai Co., Ltd. (JP) 1994-01-19 EP disclosed
US-5100901-A Treatment of Alzheimer*s disease EISAI CO., LTD. (JP) 1992-03-31 US disclosed
US-4895841-A Cyclic amine compounds with activity against acetylcholinesterase EISAI CO., LTD. (JP) 1990-01-23 US disclosed
EP-0296560-A2 1,4-Substituted piperidines as acetylcholinesterase inhibitors and their use for the treatment of Alzheimer's disease Eisai Co., Ltd. (JP) 1988-12-28 EP disclosed