SCHEMBL8201858

SCHEMBL8201858

CN1C2CCC1C(c1ccc3ccccc3n1)C2

nearest known ligand 0.52

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
SLC6A4 P31645 3/20 0.51
SLC6A3 Q01959 3/20 0.51
SLC6A2 P23975 2/20 0.51
CHRNB2 P17787 1/20 0.47
CHRNA3 P32297 1/20 0.47
CHRNA7 P36544 1/20 0.47
CHRNA4 P43681 1/20 0.47

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
SCHEMBL8205485 0.77 SLC6A3 (0.43) SLC6A4SLC6A3SLC6A2
SCHEMBL13595971 0.73 SLC6A2 (0.81) SLC6A4SLC6A3SLC6A2
SCHEMBL14911800 0.70 CYP3A4 (0.47)
SCHEMBL1177861 0.69 SLC6A2 (0.55) SLC6A4SLC6A3SLC6A2CHRNA7
SCHEMBL1177859 0.69 SLC6A2 (0.55) SLC6A4SLC6A3SLC6A2CHRNA7
SCHEMBL9366067 0.69 SLC6A2 (0.55) SLC6A4SLC6A3SLC6A2CHRNA7
SCHEMBL4437035 0.68 HRH3 (0.53)
SCHEMBL6798152 0.68 SLC6A2 (1.00) SLC6A4SLC6A3SLC6A2
SCHEMBL8419814 0.68 SLC6A2 (1.00) SLC6A4SLC6A3SLC6A2
SCHEMBL8416666 0.68 SLC6A2 (1.00) SLC6A4SLC6A3SLC6A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6060473-A 7-azabicyclo[2.2.1]-heptane and -heptene derivatives as cholinergic receptor ligands UCB S.A. - DTB (BE) 2000-05-09 US disclosed
EP-0778835-A4 7-AZABICYCLO 2.2.1]-HEPTANE AND -HEPTENE DERIVATIVES AS CHOLINERGIC RECEPTOR LIGANDS UNIV VIRGINIA (US) 1999-02-03 EP disclosed
EP-0778835-A1 7-AZABICYCLO 2.2.1]-HEPTANE AND -HEPTENE DERIVATIVES AS CHOLINERGIC RECEPTOR LIGANDS UNIVERSITY OF VIRGINIA (US) 1997-06-18 EP disclosed
WO-1996006093-A1 7-AZABICYCLO[2.2.1]-HEPTANE AND -HEPTENE DERIVATIVES AS CHOLINERGIC RECEPTOR LIGANDS UNIVERSITY OF VIRGINIA (US) 1996-02-29 WO disclosed