SCHEMBL8205485

SCHEMBL8205485

COC(=O)N1C2CCC1C(c1ccc3ccccc3n1)C2

nearest known ligand 0.43

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
SLC6A3 Q01959 9/20 0.43
SLC6A4 P31645 7/20 0.43
OPRK1 P41145 1/20 0.42
TRPM5 Q9NZQ8 1/20 0.41
SLC6A2 P23975 5/20 0.40

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
SCHEMBL9219961 0.77 SLC6A3 (0.59) SLC6A3SLC6A4SLC6A2
SCHEMBL8201858 0.77 SLC6A4 (0.51) SLC6A3SLC6A4SLC6A2
SCHEMBL16278692 0.72 TRPM5 (0.54) SLC6A3SLC6A4OPRK1TRPM5SLC6A2
SCHEMBL16283864 0.72 TRPM5 (0.54) SLC6A3SLC6A4OPRK1TRPM5SLC6A2
SCHEMBL16278689 0.72 TRPM5 (0.54) SLC6A3SLC6A4OPRK1TRPM5SLC6A2
SCHEMBL7955583 0.71 CHRNB2 (0.44) SLC6A3SLC6A4SLC6A2
SCHEMBL7957728 0.71 IDO1 (0.38) SLC6A3SLC6A4SLC6A2
SCHEMBL7959490 0.71 SLC6A3 (0.39) SLC6A3SLC6A4SLC6A2
SCHEMBL7948346 0.69 CHRNB2 (0.62) SLC6A3SLC6A4SLC6A2
SCHEMBL7962213 0.68 SLC6A4 (0.44) SLC6A3SLC6A4SLC6A2

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-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