SCHEMBL28097152

SCHEMBL28097152

CCNC1CCN(Cc2ccccc2)CC1.Clc1cccc(Cl)c1

nearest known ligand 0.62

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
ACHE P22303 9/20 0.62
BACE1 P56817 9/20 0.62
BCHE P06276 6/20 0.62
MEN1 O00255 3/20 0.61
KMT2A Q03164 3/20 0.61
SIGMAR1 Q99720 2/20 0.60
KDM4E B2RXH2 1/20 0.58
ALDH1A1 P00352 1/20 0.58
GLA P06280 1/20 0.58
GAA P10253 1/20 0.58
MAPT P10636 1/20 0.58
HTT P42858 1/20 0.58
ATM Q13315 1/20 0.58
L3MBTL1 Q9Y468 1/20 0.58
SLC6A12 P48065 1/20 0.55
CARM1 Q86X55 1/20 0.54
PRMT6 Q96LA8 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
SCHEMBL2498286 0.90 ACHE (0.73) ACHEBACE1BCHEMEN1KMT2A
Hydrochloric Acid SCHEMBL2766858 0.89 ACHE (0.71) ACHEBACE1BCHEMEN1KMT2A
SCHEMBL1801792 0.85 ACHE (0.76) ACHEBACE1BCHEMEN1KMT2A
SCHEMBL7504191 0.81 BCHE (0.75) ACHEBACE1BCHE
SCHEMBL1908453 0.81 BCHE (0.75) ACHEBACE1BCHE
SCHEMBL1781710 0.81 BCHE (0.75) ACHEBACE1BCHE
SCHEMBL13202576 0.79 SIGMAR1 (0.62) SIGMAR1KDM4EALDH1A1GLAGAA
SCHEMBL8408493 0.79 ACHE (0.69) ACHEBACE1BCHEMEN1KMT2A
SCHEMBL4902967 0.78 ACHE (0.64) ACHEBACE1BCHEMEN1KMT2A
SCHEMBL14367985 0.76 ACHE (1.00) ACHEBACE1BCHEMEN1KMT2A

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
CN-104758286-B Application of 1-benzyl-4- (2, 4-dichlorophenethylamine) piperidine in preparation of antitumor drugs 南京工业大学 2016-09-14 CN disclosed