SCHEMBL1114944

SCHEMBL1114944

COc1cc2c(cc1OC)C(=O)C(CC1CCNCC1)C2

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ACHE P22303 9/20 0.63
BCHE P06276 6/20 0.60
FAAH O00519 1/20 0.60
ABCC4 O15439 1/20 0.60
CACNA1F O60840 1/20 0.60
PDE5A O76074 1/20 0.60
ABCB11 O95342 1/20 0.60
APP P05067 1/20 0.60
CHRM2 P08172 1/20 0.60
ABCB1 P08183 1/20 0.60
CYP3A4 P08684 1/20 0.60
CHRM5 P08912 1/20 0.60
ADRA2A P08913 1/20 0.60
CHRM1 P11229 1/20 0.60
ADRA2C P18825 1/20 0.60
DRD4 P21917 1/20 0.60
SLC6A2 P23975 1/20 0.60
MAOB P27338 1/20 0.60
AGTR1 P30556 1/20 0.60
ADRA1A P35348 1/20 0.60

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
SCHEMBL29550221 1.00 ACHE (0.63) ACHEBCHEFAAHABCC4CACNA1F
Hydrochloric Acid SCHEMBL4833887 0.99 ACHE (0.61) ACHEBCHEFAAHABCC4CACNA1F
SCHEMBL28409784 0.99 ACHE (0.61) ACHEBCHEFAAHABCC4CACNA1F
Acetic Acid SCHEMBL27493902 0.94 ACHE (0.60) ACHEBCHEFAAHABCC4CACNA1F
Acetic Acid SCHEMBL29374009 0.94 ACHE (0.60) ACHEBCHEFAAHABCC4CACNA1F
SCHEMBL13317859 0.91 ACHE (0.54) ACHEBCHEFAAHABCC4CACNA1F
SCHEMBL14156625 0.91 ACHE (0.54) ACHEBCHEFAAHABCC4CACNA1F
SCHEMBL4198622 0.87 ACHE (0.56) ACHEBCHEFAAHABCC4CACNA1F
SCHEMBL14215561 0.86 ACHE (0.80) ACHEBCHEFAAHABCC4CACNA1F
SCHEMBL5442562 0.85 ACHE (0.61) ACHEBCHEFAAHABCC4CACNA1F

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 186 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-120117949-A Method for directly preparing tertiary amine compound from aromatic aldehyde, ketone and secondary amine 湖南大学 2025-06-10 CN claimed
CN-112641773-A Composition containing heterocyclic compound and use thereof 黄泳华 2021-04-13 CN claimed
CN-111265524-A Compositions containing mixtures of indene or indane derivatives and uses thereof 黄泳华 2020-06-12 CN claimed
EP-1966136-B1 NOVEL PROCESS FOR PRODUCTION OF HIGHLY PURE POLYMORPH (I) DONEPEZIL HYDROCHLORIDE RICHTER GEDEON NYRT (HU) 2014-02-26 EP claimed
US-20100105916-A1 Processes for Preparing Donepezil Sterling Biotech Limited (IN) 2010-04-29 US claimed
EP-1773339-A4 CRYSTALLINE FORM OF DONEPEZIL HYDROCHLORIDE REDDYS LAB LTD DR (IN) 2009-07-29 EP claimed
US-20080306271-A1 Novel Process for Production of Highly Pure Polymorph (I) Donepezil Hydrochloride RICHTER GEDEON NYRT. (HU) 2008-12-11 US claimed
US-7446203-B2 Preparation of intermediates for acetycholinesterase inhibitors HETERO DRUGS LIMITED (IN) 2008-11-04 US claimed
EP-1966136-A2 NOVEL PROCESS FOR PRODUCTION OF HIGHLY PURE POLYMORPH (I) DONEPEZIL HYDROCHLORIDE Richter Gedeon NYRT (HU) 2008-09-10 EP claimed
US-20080114173-A1 Crystalline Form of Donepezil Hydrochloride DR. REDDY'S LABORATORIES, INC. 2008-05-15 US claimed
EP-1773339-A2 CRYSTALLINE FORM OF DONEPEZIL HYDROCHLORIDE Dr. Reddy's Laboratories Ltd. (IN) 2007-04-18 EP claimed
EP-1531151-B1 A process for the preparation of 1-benzyl-4-¬(5,6-dimethoxy-1-indanon)-2-yl| methyl piperidine hydrochloride (donepezil hcl) USV LTD (IN) 2007-03-07 EP claimed
US-7148354-B2 Process for preparation of donepezil DR. REDDY'S LABORATORIES LIMITED (IN) 2006-12-12 US claimed
EP-1654230-A1 PREPARATION OF INTERMEDIATES FOR ACETYL CHOLINESTERASE INHIBITORS Hetero Drugs Limited (IN) 2006-05-10 EP claimed
US-20060041140-A1 5,6-dimethoxy-2-(4-pyridyl)methyl-1-indanone is hydrogenated using platinum oxide catalyst in the presence of hydrochloric acid under a pressure of 2 bars to give 4-[(5,6-dimethoxy-1-indanon)-2-yl]methylpiperidine hydrochloride HETERO DRUGS LIMITED (IN) 2006-02-23 US claimed
WO-2006015338-A2 CRYSTALLINE FORM OF DONEPEZIL HYDROCHLORIDE DR. REDDY'S LABORATORIES LTD. (IN) 2006-02-09 WO claimed
EP-1531151-A1 A process for the preparation of 1-benzyl-4-[(5,6-dimethoxy-1-indanon)-2-yl] methyl piperidine hydrochloride (donepezil hcl) USV Limited (IN) 2005-05-18 EP claimed
WO-2005003092-A1 PREPARATION OF INTERMEDIATES FOR ACETYL CHOLINESTERASE INHIBITORS HETERO DRUGS LIMITED (IN) 2005-01-13 WO claimed
US-20040143121-A1 Process for preparation of donepezil DR. REDDY'S LABORATORIES LIMITED 2004-07-22 US claimed
US-6649765-B1 Hydrogenating 5,6-Dimethoxy-2-(pyridin-4-yl)methylene indan-1-one in the presence of catalysts, then alkylating with benzyl bromide, to form drugs used for prophylaxis of nervous system disorders; by product inhibition USV LIMITED, BSD MARG. (IN) 2003-11-18 US claimed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (5 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20080306271-A1 Novel Process for Production of Highly Pure Polymorph (I) Donepezil Hydrochloride DRD4, IDO1, ADH1A ACHE 71/4885BCHE 20/4885FAAH 1333/4885
US-20080114173-A1 Crystalline Form of Donepezil Hydrochloride PSEN1, H1-5, BCHE ACHE 4/4885BCHE 3/4885FAAH 1239/4885
US-20060041140-A1 5,6-dimethoxy-2-(4-pyridyl)methyl-1-indanone is hydrogenated using platinum oxide catalyst in the presence of hydrochloric acid under a pressure of 2 bars to give 4-[(5,6-dimethoxy-1-indanon)-2-yl]methylpiperidine hydrochloride ACHE, IDH2, IMPDH2 ACHE 1/4885BCHE 12/4885FAAH 3009/4885
US-20040143121-A1 Process for preparation of donepezil ACHE, ADH1C, COMT ACHE 1/4885BCHE 16/4885FAAH 1191/4885
US-20100105916-A1 Processes for Preparing Donepezil HNMT, PNMT, PSEN1 ACHE 4/4885BCHE 29/4885FAAH 3543/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.