SCHEMBL4552893

SCHEMBL4552893

CCCCC(CC(N)=O)C1CCCCN1

nearest known ligand 0.44

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
SLC6A3 Q01959 11/20 0.44
SLC6A2 P23975 10/20 0.44
SLC6A4 P31645 9/20 0.44
DPP7 Q9UHL4 1/20 0.39
SIGMAR1 Q99720 1/20 0.35

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
SCHEMBL4552040 0.87 SLC6A3 (0.45) SLC6A3SLC6A2SLC6A4DPP7
SCHEMBL4553208 0.83 SLC6A3 (0.42) SLC6A3SLC6A2SLC6A4DPP7
SCHEMBL8395460 0.79 SLC6A3 (0.43) SLC6A3SLC6A2SLC6A4DPP7
SCHEMBL24654963 0.79 SLC6A2 (0.52) SLC6A3SLC6A2SLC6A4DPP7
SCHEMBL26488994 0.79 SLC6A2 (0.52) SLC6A3SLC6A2SLC6A4DPP7
SCHEMBL20841352 0.78 SLC6A2 (0.48) SLC6A3SLC6A2SLC6A4DPP7SIGMAR1
Hydrochloric Acid SCHEMBL8394606 0.77 SLC6A2 (0.43) SLC6A3SLC6A2SLC6A4
SCHEMBL21226033 0.77 SLC6A2 (0.54) SLC6A3SLC6A2SLC6A4
SCHEMBL24833572 0.77 SLC6A2 (0.54) SLC6A3SLC6A2SLC6A4
Acetic Acid SCHEMBL29252308 0.76 SLC6A3 (0.45) SLC6A3SLC6A2SLC6A4

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-1612207-B1 Processes and intermediates for preparing 2-substituted piperidine stereoisomers CELGENE CORP (US) 2009-01-07 EP claimed
EP-1612207-A1 Processes and intermediates for preparing 2-substituted piperidine stereoisomers CELGENE CORPORATION (US) 2006-01-04 EP claimed