SCHEMBL5142240

SCHEMBL5142240

CN(C)CCCC1(c2ccc(Cl)c(Cl)c2)CCCCC1

nearest known ligand 0.69

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
SLC6A4 P31645 20/20 0.69
SLC6A3 Q01959 19/20 0.69
SLC6A2 P23975 14/20 0.69

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
SCHEMBL5089570 0.91 SLC6A4 (0.73) SLC6A4SLC6A3SLC6A2
Hydrochloric Acid SCHEMBL5304508 0.90 SLC6A4 (0.65) SLC6A4SLC6A3SLC6A2
SCHEMBL11104526 0.87 SLC6A4 (0.72) SLC6A4SLC6A3SLC6A2
Hydrochloric Acid SCHEMBL5311554 0.85 SLC6A4 (0.70) SLC6A4SLC6A3SLC6A2
SCHEMBL14775504 0.84 SLC6A4 (0.67) SLC6A4SLC6A3SLC6A2
SCHEMBL3520161 0.82 SLC6A4 (1.00) SLC6A4SLC6A3SLC6A2
SCHEMBL7900799 0.82 SLC6A4 (0.75) SLC6A4SLC6A3SLC6A2
Hydrochloric Acid SCHEMBL3515738 0.81 SLC6A4 (0.97) SLC6A4SLC6A3SLC6A2
SCHEMBL15043689 0.80 SLC6A4 (0.66) SLC6A4SLC6A3SLC6A2
SCHEMBL3517854 0.80 SLC6A4 (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
EP-2974724-A1 PYRROLIDINE TRIPLE REUPTAKE INHIBITORS Sunovion Pharmaceuticals Inc. (US) 2016-01-20 EP disclosed
WO-2010091268-A1 PYRROLIDINE TRIPLE REUPTAKE INHIBITORS SEPRACOR INC. (US) 2010-08-12 WO disclosed
EP-1976513-A2 CYCLOALKYLAMINES AS MONOAMINE REUPTAKE INHIBITORS Sepracor, Inc. (US) 2008-10-08 EP disclosed
WO-2007081857-A2 CYCLOALKYLAMINES AS MONOAMINE REUPTAKE INHIBITORS SEPRACOR INC. (US) 2007-07-19 WO disclosed