SCHEMBL6047909

SCHEMBL6047909

CNCC[C@@H](c1cccc(F)c1)n1ccc2ccccc21

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
SLC6A2 P23975 19/20 1.00
SLC6A4 P31645 17/20 1.00

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
SCHEMBL2074806 0.86 SLC6A2 (0.80) SLC6A2SLC6A4
SCHEMBL2074980 0.86 SLC6A2 (1.00) SLC6A2SLC6A4
SCHEMBL5731601 0.85 SLC6A2 (0.73) SLC6A2SLC6A4
SCHEMBL5728552 0.84 SLC6A2 (0.72) SLC6A2SLC6A4
SCHEMBL5729578 0.84 SLC6A2 (0.72) SLC6A2SLC6A4
SCHEMBL28765777 0.83 SLC6A2 (0.71) SLC6A2SLC6A4
SCHEMBL2073496 0.82 SLC6A2 (0.70) SLC6A2SLC6A4
SCHEMBL2075091 0.82 SLC6A2 (0.70) SLC6A2SLC6A4
SCHEMBL27668131 0.81 SLC6A2 (0.67) SLC6A2SLC6A4
SCHEMBL5729863 0.79 SLC6A2 (0.65) SLC6A2SLC6A4

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-1730127-A1 HETEROCYCLIC PHENYLAMINOPROPANOL DERIVATIVES AS MODULATORS OF THE MONOAMINE REUPTAKE FOR THE TREATMENT OF VASOMOTOR SYMPTOMS (VMS) Wyeth, A Corporation of the State of Delaware (US) 2006-12-13 EP disclosed
WO-2005097761-A1 HETEROCYCLIC PHENYLAMINOPROPANOL DERIVATIVES AS MODULATORS OF THE MONOAMINE REUPTAKE FOR THE TREATMENT OF VASOMOTOR SYMPTOMS (VMS) WYETH (US) 2005-10-20 WO disclosed