SCHEMBL7235146

SCHEMBL7235146

Clc1cccc(OCCCN2CC=CCC2)c1

nearest known ligand 0.64

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
MAOA P21397 1/20 0.64
MAOB P27338 1/20 0.64
LMNA P02545 1/20 0.61
MAPK1 P28482 1/20 0.61
HTT P42858 1/20 0.61
SMN1; SMN2 Q16637 1/20 0.61
HRH3 Q9Y5N1 13/20 0.60
KMT2A Q03164 2/20 0.54
MEN1 O00255 1/20 0.54
CYP2D6 P10635 1/20 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
SCHEMBL7235354 0.84 HRH3 (0.60) MAOAMAOBSMN1; SMN2HRH3KMT2A
SCHEMBL7230184 0.82 MAOA (0.62) MAOAMAOBSMN1; SMN2HRH3KMT2A
SCHEMBL7228164 0.78 MAOA (0.57) MAOAMAOBSMN1; SMN2HRH3KMT2A
SCHEMBL7228236 0.78 MAOA (1.00) MAOAMAOBLMNAMAPK1SMN1; SMN2
SCHEMBL491864 0.77 MAOA (0.59) MAOAHRH3
SCHEMBL491593 0.76 HRH3 (0.97) LMNAMAPK1HTTSMN1; SMN2HRH3
SCHEMBL25364075 0.75 MAOA (0.58) MAOAMAOB
SCHEMBL5856321 0.75 HRH3 (0.94) LMNAMAPK1HTTSMN1; SMN2HRH3
SCHEMBL7228418 0.75 KDM4E (0.62) MAOAMAOBLMNAMAPK1HTT
SCHEMBL21004107 0.75 HRH3 (0.80) LMNAMAPK1HTTSMN1; SMN2HRH3

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
US-6649623-B1 Administering tetrahydropiperidine derivative; antidiabetic agents; hyperlipemia treatment; hypotensive agents SHIONOGI & CO., LTD. (JP) 2003-11-18 US disclosed
EP-1151993-A1 CYCLIC AMINE DERIVATIVES AND USES THEREOF SHIONOGI & CO., LTD. (JP) 2001-11-07 EP disclosed