SCHEMBL1421752

SCHEMBL1421752

NCCC1CCC(CN)CO1

nearest known ligand 0.34

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
SLC6A2 P23975 2/20 0.34
SLC6A4 P31645 2/20 0.34
SLC6A3 Q01959 2/20 0.34
PLG P00747 1/20 0.30
PLAT P00750 1/20 0.30
LMNA P02545 1/20 0.30

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
SCHEMBL3695547 0.84 PLG (0.33) SLC6A2SLC6A4SLC6A3PLGPLAT
SCHEMBL4448352 0.83 SLC6A2 (0.33) SLC6A2SLC6A4SLC6A3
SCHEMBL3634713 0.76 SLC6A2 (0.35) SLC6A2SLC6A4SLC6A3
SCHEMBL14690635 0.71
SCHEMBL14975473 0.71
SCHEMBL10197447 0.70
SCHEMBL1421753 0.69 SLC6A2 (0.32) SLC6A2SLC6A4SLC6A3
SCHEMBL23776301 0.68 EPHX1 (0.32) SLC6A2SLC6A4SLC6A3
SCHEMBL1421599 0.68 PLG (0.44) PLGPLATLMNA
SCHEMBL16654044 0.68 SLC6A4 (0.57) SLC6A2SLC6A4SLC6A3

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
EP-2297107-A1 Ý4-(1-AMINO-ETHYL) -CYCLOHEXYL¨-METHYL-AMINE AND Ý6-(1-AMINO-ETHYL) -TETRAHYDRO- PYRAN-3-YL¨-METHYL-AMINE DERIVATIVES AS ANTIBACTERIALS Actelion Pharmaceuticals Ltd. (CH) 2011-03-23 EP disclosed
WO-2009147616-A1 [4-(1-AMINO-ETHYL) -CYCLOHEXYL] -METHYL-AMINE AND [6-(1-AMINO-ETHYL) -TETRAHYDRO- PYRAN-3-YL] -METHYL-AMINE DERIVATIVES AS ANTIBACTERIALS ACTELION PHARMACEUTICALS LTD (CH) 2009-12-10 WO disclosed