SCHEMBL4331978

SCHEMBL4331978

Clc1ccc(C2CCCCC2)cc1Cl

nearest known ligand 0.68

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
SLC6A2 P23975 9/20 0.68
SLC6A4 P31645 9/20 0.68
SLC6A3 Q01959 9/20 0.68
KCNH2 Q12809 7/20 0.68
CYP2D6 P10635 7/20 0.68
ACMSD Q8TDX5 1/20 0.44

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
SCHEMBL15335800 0.98 SLC6A2 (0.70) SLC6A2SLC6A4SLC6A3KCNH2CYP2D6
SCHEMBL2407 0.93 SLC6A2 (0.65) SLC6A2SLC6A4SLC6A3KCNH2CYP2D6
SCHEMBL9870878 0.89 SLC6A2 (0.58) SLC6A2SLC6A4SLC6A3KCNH2CYP2D6
SCHEMBL3786167 0.83 SLC6A2 (0.50) SLC6A2SLC6A4SLC6A3KCNH2CYP2D6
SCHEMBL3787199 0.83 SLC6A2 (0.50) SLC6A2SLC6A4SLC6A3KCNH2CYP2D6
Formic Acid SCHEMBL28268519 0.83 SLC6A2 (0.54) SLC6A2SLC6A4SLC6A3KCNH2CYP2D6
SCHEMBL19785356 0.83 SLC6A2 (0.53) SLC6A2SLC6A4SLC6A3KCNH2CYP2D6
SCHEMBL3786150 0.82 SLC6A2 (0.49) SLC6A2SLC6A4SLC6A3KCNH2CYP2D6
SCHEMBL8331330 0.82 SLC6A2 (0.49) SLC6A2SLC6A4SLC6A3KCNH2CYP2D6
SCHEMBL19051115 0.82 SLC6A3 (0.49) SLC6A2SLC6A4SLC6A3KCNH2CYP2D6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3296289-A2 PHENYL SUBSTITUTED CYCLOALKYLAMINES AS MONOAMINE REUPTAKE INHIBITORS Sunovion Pharmaceuticals Inc. (US) 2018-03-21 EP disclosed
EP-2617704-B1 Phenyl substituted cycloalkylamines as monoamine reuptake inhibitors SUNOVION PHARMACEUTICALS INC (US) 2017-06-28 EP disclosed
WO-2009145357-A1 IN 1-POSITION DURCH EINEN RING SUBSTITUIERTE BENZO [1, 4] DIAZEPINE ZUR VERWENDUNGS ALS ANTIDEPRESSIVA OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2009-12-03 WO disclosed