SCHEMBL7776280

SCHEMBL7776280

O=C(O)CC(=O)OCC1CCN(Cc2ccccc2)CC1

nearest known ligand 0.69

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
ACHE P22303 5/20 0.69
BCHE P06276 4/20 0.69
MAOB P27338 1/20 0.69
DRD2 P14416 3/20 0.64
DRD4 P21917 2/20 0.64
CHRM3 P20309 1/20 0.64
L3MBTL1 Q9Y468 1/20 0.55
CXCR4 P61073 1/20 0.55
HTR2A P28223 1/20 0.54
HTR2C P28335 1/20 0.54
HTR2B P41595 1/20 0.54
SIGMAR1 Q99720 1/20 0.54
CCR3 P51677 1/20 0.54

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
SCHEMBL7776278 0.94 ACHE (0.72) ACHEBCHEMAOBDRD2DRD4
SCHEMBL20656948 0.85 BCHE (0.70) ACHEBCHEMAOBDRD2DRD4
SCHEMBL28437119 0.83 BCHE (0.68) ACHEBCHEMAOBDRD2DRD4
SCHEMBL8549859 0.82 DRD2 (0.85) ACHEBCHEMAOBDRD2DRD4
Hydrochloric Acid SCHEMBL8555532 0.81 DRD2 (0.83) ACHEBCHEMAOBDRD2DRD4
SCHEMBL1317607 0.80 BCHE (0.70) ACHEBCHEMAOBDRD2DRD4
SCHEMBL8059465 0.79 LMNA (0.46) ACHEBCHEMAOB
Hydrochloric Acid SCHEMBL1314603 0.79 BCHE (0.69) ACHEBCHEMAOBDRD2DRD4
SCHEMBL10740997 0.78 BCHE (0.56) ACHEBCHEMAOBDRD2DRD4
Hydrochloric Acid SCHEMBL7777099 0.78 SIGMAR1 (0.60) ACHEBCHEMAOBDRD2DRD4

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-1129073-A2 PROCESS AND INTERMEDIATES FOR PRODUCTION OF DONEPEZIL AND RELATED COMPOUNDS Finetech Ltd (IL) 2001-09-05 EP disclosed
WO-2000009483-A2 PROCESS AND INTERMEDIATES FOR PRODUCTION OF DONEPEZIL AND RELATED COMPOUNDS FINETECH LTD. (IL) 2000-02-24 WO disclosed