SCHEMBL5776335

SCHEMBL5776335

CC(C)CN(Cc1ccco1)C1CCNCC1.Cc1cccc(CN(CC(C)C)C2CCNCC2)n1

nearest known ligand 0.50

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
SLC6A2 P23975 20/20 0.50
SLC6A4 P31645 18/20 0.50
SLC6A3 Q01959 9/20 0.50

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
SCHEMBL3268016 0.89 SLC6A2 (0.60) SLC6A2SLC6A4SLC6A3
SCHEMBL5776339 0.88 HTT (0.39) SLC6A2SLC6A4SLC6A3
SCHEMBL3272685 0.87 SLC6A2 (0.63) SLC6A2SLC6A4SLC6A3
Fumaric Acid SCHEMBL3268699 0.80 SLC6A2 (0.67) SLC6A2SLC6A4SLC6A3
Fumaric Acid SCHEMBL3268694 0.80 SLC6A2 (0.67) SLC6A2SLC6A4SLC6A3
Fumaric Acid SCHEMBL3267117 0.78 SLC6A2 (0.66) SLC6A2SLC6A4SLC6A3
Fumaric Acid SCHEMBL3267112 0.78 SLC6A2 (0.66) SLC6A2SLC6A4SLC6A3
SCHEMBL13307095 0.71 SLC6A2 (0.61) SLC6A2SLC6A4SLC6A3
SCHEMBL6186637 0.70 SLC6A2 (0.73) SLC6A2SLC6A4SLC6A3
SCHEMBL4492237 0.69 SLC6A2 (0.64) 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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1735302-A1 4-AMINO-PIPERIDINE DERIVATIVES AS MONOAMINE UPTAKE INHIBITORS ELI LILLY AND COMPANY (US) 2006-12-27 EP disclosed
WO-2005092885-A1 4-AMINO-PIPERIDINE DERIVATIVES AS MONOAMINE UPTAKE INHIBITORS ELI LILLY AND COMPANY (US) 2005-10-06 WO disclosed