SCHEMBL4690066

SCHEMBL4690066

CCCN(Cc1ccccc1C(F)(F)F)[C@H]1CCN(C(=O)O)C1C(C)(C)C

nearest known ligand 0.54

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
SLC6A2 P23975 20/20 0.54
SLC6A4 P31645 20/20 0.54
SLC6A3 Q01959 4/20 0.45

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
SCHEMBL4687367 0.82 SLC6A2 (0.43) SLC6A2SLC6A4SLC6A3
SCHEMBL5925320 0.82 SLC6A2 (0.53) SLC6A2SLC6A4SLC6A3
SCHEMBL5127976 0.78 SLC6A2 (0.52) SLC6A2SLC6A4SLC6A3
SCHEMBL5112330 0.77 SLC6A2 (0.42) SLC6A2SLC6A4SLC6A3
SCHEMBL4497702 0.77 SLC6A2 (0.60) SLC6A2SLC6A4SLC6A3
SCHEMBL5696046 0.75 SIGMAR1 (0.45)
SCHEMBL5887848 0.71 SLC6A2 (0.50) SLC6A2SLC6A4SLC6A3
SCHEMBL4690064 0.71 SLC6A2 (0.53) SLC6A2SLC6A4
SCHEMBL6264470 0.71 KDM4E (0.47)
SCHEMBL5232639 0.71 SLC6A2 (0.49) 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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1638934-B1 3-AMINOPYRROLIDINES AS INHIBITORS OF MONOAMINE UPTAKE LILLY CO ELI (US) 2008-01-09 EP disclosed