SCHEMBL12810312

SCHEMBL12810312

Bc1ccccc1CCO[C@H]1CCCCC1N1CCOCC1

nearest known ligand 0.71

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
KCNA5 P22460 9/20 0.71
SCN5A Q14524 9/20 0.71
SLC6A4 P31645 1/20 0.36
KCND2 Q9NZV8 5/20 0.35
KCNH2 Q12809 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
OPRM1 P35372 3/20 0.33
SLC18A3 Q16572 3/20 0.32
OPRK1 P41145 2/20 0.32
OPRD1 P41143 1/20 0.32

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
SCHEMBL2624922 0.85 KCNA5 (0.71) KCNA5SCN5ASLC6A4KCND2SLC18A3
SCHEMBL3584661 0.85 KCNA5 (0.71) KCNA5SCN5ASLC6A4KCND2SLC18A3
SCHEMBL1762216 0.85 KCNA5 (0.71) KCNA5SCN5ASLC6A4KCND2SLC18A3
SCHEMBL14434183 0.85 KCNA5 (0.71) KCNA5SCN5ASLC6A4KCND2KCNH2
SCHEMBL1762201 0.85 KCNA5 (0.71) KCNA5SCN5ASLC6A4KCND2SLC18A3
Hydrochloric Acid SCHEMBL909033 0.84 KCNA5 (0.70) KCNA5SCN5ASLC6A4KCND2KCNH2
Hydrochloric Acid SCHEMBL909031 0.84 KCNA5 (0.70) KCNA5SCN5ASLC6A4KCND2KCNH2
SCHEMBL6807137 0.83 KCNA5 (1.00) KCNA5SCN5ASLC6A4
SCHEMBL12391697 0.83 KCNA5 (1.00) KCNA5SCN5ASLC6A4
SCHEMBL2624914 0.83 KCNA5 (1.00) KCNA5SCN5ASLC6A4

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
EP-2298735-A1 Aminocyclohexyl ether compounds and uses thereof Cardiome Pharma Corp. (CA) 2011-03-23 EP disclosed