SCHEMBL218589

SCHEMBL218589

CCOc1cc2c(cc1OCC)C(=O)C(CC1CCN(Cc3ccccc3)CC1)C2

nearest known ligand 0.81

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
BCHE P06276 7/20 0.81
ACHE P22303 7/20 0.81
FAAH O00519 1/20 0.81
ABCC4 O15439 1/20 0.81
CACNA1F O60840 1/20 0.81
PDE5A O76074 1/20 0.81
ABCB11 O95342 1/20 0.81
APP P05067 1/20 0.81
CHRM2 P08172 1/20 0.81
ABCB1 P08183 1/20 0.81
CYP3A4 P08684 1/20 0.81
CHRM5 P08912 1/20 0.81
ADRA2A P08913 1/20 0.81
CHRM1 P11229 1/20 0.81
ADRA2C P18825 1/20 0.81
DRD4 P21917 1/20 0.81
SLC6A2 P23975 1/20 0.81
MAOB P27338 1/20 0.81
AGTR1 P30556 1/20 0.81
ADRA1A P35348 1/20 0.81

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
Hydrochloric Acid SCHEMBL4199744 0.99 BCHE (0.81) BCHEACHEFAAHABCC4CACNA1F
SCHEMBL4207911 0.96 BCHE (0.89) BCHEACHEFAAHABCC4CACNA1F
SCHEMBL4201561 0.96 BCHE (0.89) BCHEACHEFAAHABCC4CACNA1F
Hydrochloric Acid SCHEMBL4199958 0.95 BCHE (0.89) BCHEACHEFAAHABCC4CACNA1F
Hydrochloric Acid SCHEMBL4206051 0.95 BCHE (0.89) BCHEACHEFAAHABCC4CACNA1F
SCHEMBL24401407 0.93 BCHE (0.74) BCHEACHEFAAHABCC4CACNA1F
SCHEMBL14242699 0.92 BCHE (0.72) BCHEACHEFAAHABCC4CACNA1F
SCHEMBL6586992 0.92 BCHE (0.78) BCHEACHEFAAHABCC4CACNA1F
SCHEMBL4201713 0.91 ACHE (0.83) BCHEACHEFAAHABCC4CACNA1F
SCHEMBL4200725 0.91 ACHE (0.81) BCHEACHEFAAHABCC4CACNA1F

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20110053981-A1 Methods and Compositions Using Cholinesterase Inhibitors EISAI R&D MANAGEMENT CO., LTD. (JP) 2011-03-03 US claimed
EP-2140868-A1 Use of a cholinesterase inhibitor for the treatment of dementia and cognitive impairments associated with or caused by chemotherapy Eisai R&D Management Co., Ltd. (JP) 2010-01-06 EP claimed
EP-2138177-A1 Use of a cholinesterase inhibitor for the treatment of dementia and cognitive impairments Eisai R&D Management Co., Ltd. (JP) 2009-12-30 EP claimed
EP-2133078-A1 Use of a cholinesterase inhibitor for the treatment of dementia and cognitive impairments Eisai R&D Management Co., Ltd. (JP) 2009-12-16 EP claimed
EP-2130538-A1 Use of a cholinesterase inhibitor for the delaying the onset of Alzheimer's disease Eisai R&D Management Co., Ltd. (JP) 2009-12-09 EP claimed
US-20090137629-A1 Sigma receptor binding agent containing indanone derivative IIMURA YOICHI 2009-05-28 US claimed
US-20090042940-A1 METHODS AND COMPOSITIONS USING CHOLINESTERASE INHIBITORS EISAI CO., LTD. (JP) 2009-02-12 US claimed
US-20090042939-A1 Methods and Compositions Using Cholinesterase Inhibitors EISAI CO., LTD. (JP) 2009-02-12 US claimed
US-20080312189-A1 Cadasil Treatment with Cholinesterase Inhibitors EISAI CO., LTD. (JP) 2008-12-18 US claimed
EP-1729761-A4 CADASIL TREATMENT WITH CHOLINESTERASE INHIBITORS EISAI CO LTD (JP) 2008-09-03 EP claimed
EP-1311272-A1 NOVEL METHODS USING CHOLINESTERASE INHIBITORS Eisai Co., Ltd. (JP) 2003-05-21 EP claimed
US-20030055040-A1 Cholinesterase inhibitors to treat disorders of attention EISAI R&D MANAGEMENT CO., LTD. (JP) 2003-03-20 US claimed
US-20030045449-A1 Pharmaceutical combinations for the treatment of neurodegenerative diseases PFIZER, INC. 2003-03-06 US claimed
EP-1201268-A2 Combinations of D4 dopamine receptor antagonists with acetylcholine esterase inhibitors Pfizer Products Inc. (US) 2002-05-02 EP claimed
US-20020052373-A1 Combination treatment for dementia or cognitive deficits associated with alzheimer's disease and parkinson's disease ZORN STEVIN H (US) 2002-05-02 US claimed
WO-2001066114-A1 NOVEL METHODS USING CHOLINESTERASE INHIBITORS EISAI CO., LTD. (JP) 2001-09-13 WO claimed
EP-0742207-B1 2-(Indan-1-one-2-yl-alkyl)-1-phenylalkyl-piperidines and processes for their preparation EISAI CO LTD (JP) 2001-08-29 EP claimed
EP-0296560-B1 1,4-Substituted piperidines as acetylcholinesterase inhibitors and their use for the treatment of Alzheimer's disease EISAI CO LTD (JP) 1996-02-28 EP claimed
EP-0673927-A1 4-[2-indanyl-1-one]alkylpiperidines as anticholinergic agents Eisai Co., Ltd. (JP) 1995-09-27 EP claimed
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 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 (8 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-20020052373-A1 Combination treatment for dementia or cognitive deficits associated with alzheimer's disease and parkinson's disease ACHE, BCHE, CHRM4 BCHE 2/4885ACHE 1/4885FAAH 1075/4885
US-20030045449-A1 Pharmaceutical combinations for the treatment of neurodegenerative diseases GRIN3A, GRIN1, CHRNA10 BCHE 48/4885ACHE 27/4885FAAH 759/4885
US-20090042939-A1 Methods and Compositions Using Cholinesterase Inhibitors PSEN1, BACE1, PSENEN BCHE 137/4885ACHE 26/4885FAAH 861/4885
US-20090137629-A1 Sigma receptor binding agent containing indanone derivative SIGMAR1, TMEM97, OPRK1 BCHE 1667/4885ACHE 608/4885FAAH 2437/4885
US-20080312189-A1 Cadasil Treatment with Cholinesterase Inhibitors NOTCH3, NOTCH2, NOTCH4 BCHE 38/4885ACHE 156/4885FAAH 1617/4885
US-20110053981-A1 Methods and Compositions Using Cholinesterase Inhibitors PSEN1, BACE1, PSENEN BCHE 137/4885ACHE 26/4885FAAH 861/4885
US-20090042940-A1 METHODS AND COMPOSITIONS USING CHOLINESTERASE INHIBITORS PSEN1, BACE1, PSENEN BCHE 137/4885ACHE 26/4885FAAH 861/4885
US-20030055040-A1 Cholinesterase inhibitors to treat disorders of attention CHAT, COMT, ACHE BCHE 6/4885ACHE 3/4885FAAH 88/4885

“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.