SCHEMBL8243145

SCHEMBL8243145

COc1cc2c(cc1OC)CC(CC1CCNCC1)C2

nearest known ligand 0.66

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
BCHE P06276 2/20 0.53
ALDH1A1 P00352 1/20 0.41
CYP2D6 P10635 1/20 0.41
CYP2C9 P11712 1/20 0.41
ALOX15 P16050 1/20 0.41
MAPK1 P28482 1/20 0.41
TDP1 Q9NUW8 1/20 0.41
HTR2C P28335 3/20 0.40
HTR2A P28223 1/20 0.40
HTR2B P41595 1/20 0.40
CYP3A4 P08684 1/20 0.39
MAPT P10636 1/20 0.39
ACHE P22303 2/20 0.39

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 0.80 ACHE (0.63) BCHEHTR2BCYP3A4ACHE
SCHEMBL1114944 0.80 ACHE (0.63) BCHEHTR2BCYP3A4ACHE
Hydrochloric Acid SCHEMBL4833887 0.79 ACHE (0.61) BCHEHTR2BCYP3A4ACHE
SCHEMBL28409784 0.79 ACHE (0.61) BCHEHTR2BCYP3A4ACHE
Acetic Acid SCHEMBL27493902 0.75 ACHE (0.60) BCHEHTR2BCYP3A4ACHE
Acetic Acid SCHEMBL29374009 0.75 ACHE (0.60) BCHEHTR2BCYP3A4ACHE
SCHEMBL3149281 0.74 ALDH1A1 (0.49) BCHEALDH1A1CYP2D6CYP2C9ALOX15
SCHEMBL14156625 0.74 ACHE (0.54) BCHEHTR2BCYP3A4ACHE
SCHEMBL8267415 0.73 ACHE (0.61) TDP1HTR2CHTR2AHTR2BCYP3A4
SCHEMBL9636847 0.73 GBA1 (0.50) HTR2CHTR2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1954676-B1 PROCESS FOR MAKING DONEPEZIL SYNTHON BV (NL) 2012-11-07 EP disclosed
US-20080306271-A1 Novel Process for Production of Highly Pure Polymorph (I) Donepezil Hydrochloride RICHTER GEDEON NYRT. (HU) 2008-12-11 US disclosed
US-20080306271-A1 Novel Process for Production of Highly Pure Polymorph (I) Donepezil Hydrochloride RICHTER GEDEON NYRT. (HU) 2008-12-11 US disclosed
US-20070135644-A1 PROCESS FOR MAKING DONEPEZIL SYNTHON BV (NL) 2007-06-14 US disclosed
US-20070135644-A1 PROCESS FOR MAKING DONEPEZIL SYNTHON BV (NL) 2007-06-14 US disclosed
WO-2007057226-A2 PROCESS FOR MAKING DONEPEZIL SYNTHON B.V. (NL) 2007-05-24 WO disclosed

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

For each of this compound's patents that has machine-readable text (2 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 BCHE 20/4885ALDH1A1 322/4885CYP2D6 69/4885
US-20070135644-A1 PROCESS FOR MAKING DONEPEZIL MAOA, ACHE, CHAT BCHE 4/4885ALDH1A1 882/4885CYP2D6 84/4885

“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.