SCHEMBL8522924

SCHEMBL8522924

BCCN(C)CCNc1c2c(nc3ccccc13)CCCC2

nearest known ligand 0.77

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
ACHE P22303 7/20 0.77
BCHE P06276 2/20 0.77
HRH3 Q9Y5N1 3/20 0.75
PABPC1 P11940 1/20 0.73
EIF4H Q15056 1/20 0.73
HRH2 P25021 1/20 0.69
HRH1 P35367 1/20 0.69
RAD52 P43351 1/20 0.65

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
SCHEMBL5945394 0.89 ACHE (0.77) ACHEBCHEHRH3PABPC1EIF4H
SCHEMBL8523409 0.89 ACHE (0.81) ACHEBCHEHRH3PABPC1EIF4H
SCHEMBL15167949 0.87 ACHE (1.00) ACHEBCHEHRH3HRH2HRH1
SCHEMBL8522923 0.85 BCHE (0.78) ACHEBCHE
Hydrochloric Acid SCHEMBL31087706 0.83 PABPC1 (0.97) ACHEBCHEHRH3PABPC1EIF4H
SCHEMBL29868549 0.83 ACHE (0.69) ACHEBCHEHRH3PABPC1EIF4H
SCHEMBL1532467 0.83 ACHE (0.69) ACHEBCHEHRH3PABPC1EIF4H
SCHEMBL24000133 0.80 BCHE (0.97) ACHEBCHE
SCHEMBL13480729 0.80 BCHE (0.92) ACHEBCHE
Hydrochloric Acid SCHEMBL31087709 0.79 RAD52 (1.00) ACHEBCHEHRH3PABPC1EIF4H

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2012065527-A1 COMPOUDS AND USES AS L-TYPE CALCIUM CHANNEL BLOCKER AND/OR ACETYLCHOLINESTERASE INHIBITOR THEREOF 江苏先声药物研究有限公司 (CN) 2012-05-24 WO disclosed