SCHEMBL6380946

SCHEMBL6380946

COc1ccc2c(c1OC)C(=O)C(Cc1ccncc1)C2

nearest known ligand 0.56

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ CYP19A1 P11511 9/20 0.56
▸ ACHE P22303 3/20 0.56
▸ PDE4D Q08499 5/20 0.53

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
SCHEMBL6383533 0.86 PDE4D (0.57) CYP19A1ACHEPDE4D
SCHEMBL6384672 0.81 CYP19A1 (0.70) CYP19A1ACHEPDE4D
SCHEMBL6385559 0.80 CYP19A1 (0.73) CYP19A1ACHEPDE4D
Hydrochloric Acid SCHEMBL2332119 0.80 ACHE (0.66) ACHE
SCHEMBL6384704 0.79 CYP19A1 (0.67) CYP19A1ACHEPDE4D
Bromide SCHEMBL2335583 0.78 ACHE (0.68) ACHE
SCHEMBL1114939 0.77 PDE4D (0.81) CYP19A1ACHEPDE4D
SCHEMBL6378133 0.73 CYP19A1 (0.81) CYP19A1ACHEPDE4D
SCHEMBL6381232 0.72 CYP19A1 (1.00) CYP19A1ACHEPDE4D
SCHEMBL4881756 0.72 ACHE (0.54) ACHEPDE4D

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1047674-B1 PROCESS FOR PRODUCTION OF DONEPEZIL DERIVATIVES EISAI CO LTD (JP) 2005-03-30 — — EP disclosed
EP-1047674-A1 PROCESS FOR PRODUCTION OF DONEPEZIL DERIVATIVES Eisai Co., Ltd. (JP) 2000-11-02 — — EP disclosed
WO-1999036405-A1 PROCESS FOR PRODUCTION OF DONEPEZIL DERIVATIVE EISAI CO., LTD. (JP) 1999-07-22 — — WO disclosed
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