SCHEMBL5856367

SCHEMBL5856367

O=Cc1ccc(OCCCN2CCCCC2)cc1.[H+]

nearest known ligand 0.68

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
HRH3 Q9Y5N1 20/20 0.68
KCNH2 Q12809 3/20 0.61
ACHE P22303 1/20 0.61
RAD52 P43351 1/20 0.61
HRH1 P35367 1/20 0.60

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
SCHEMBL491848 0.98 HRH3 (0.69) HRH3KCNH2ACHERAD52HRH1
Hydrochloric Acid SCHEMBL5692315 0.97 HRH3 (0.68) HRH3KCNH2ACHERAD52HRH1
SCHEMBL2005536 0.97 HRH3 (0.67) HRH3KCNH2ACHERAD52HRH1
SCHEMBL30411052 0.94 HRH3 (0.68) HRH3KCNH2
SCHEMBL30409879 0.93 HRH3 (0.67) HRH3KCNH2
SCHEMBL30410433 0.93 HRH3 (0.67) HRH3KCNH2
SCHEMBL30409990 0.92 HRH3 (0.65) HRH3KCNH2
SCHEMBL30410512 0.91 MEN1 (0.66) HRH3KCNH2
SCHEMBL30409967 0.91 MEN1 (0.66) HRH3KCNH2
SCHEMBL27593 0.91 PSMB1 (0.69) HRH3KCNH2

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
US-7138413-B1 Administering tertiary amines, e.g., 3,3-Dimethylbutyl 3-piperidinopropyl ether, 3-Phenylpropyl 3-piperidinopropyl ether, or3-(4-Chlorophenyl)propyl 3-piperidinopropyl ether to treat cognitive disorders such as attention, wakefulness and memory disorders SOCIETE CIVILE BIOPROJET (FR) 2006-11-21 US disclosed