SCHEMBL5760423

SCHEMBL5760423

CC(C)CN(Cc1ccccc1-c1cc[nH]n1)[C@H]1CCNC1

nearest known ligand 0.54

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
SLC6A2 P23975 20/20 0.54
SLC6A4 P31645 18/20 0.54
SLC6A3 Q01959 12/20 0.54
CYP2D6 P10635 3/20 0.47
KCNH2 Q12809 1/20 0.47

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
SCHEMBL4488505 0.78 SLC6A2 (0.85) SLC6A2SLC6A4SLC6A3CYP2D6KCNH2
SCHEMBL4477264 0.78 SLC6A2 (0.55) SLC6A2SLC6A4SLC6A3CYP2D6KCNH2
SCHEMBL4486481 0.78 SLC6A2 (0.86) SLC6A2SLC6A4SLC6A3
SCHEMBL4489204 0.77 SLC6A2 (0.85) SLC6A2SLC6A4SLC6A3CYP2D6
SCHEMBL4492096 0.77 SLC6A2 (0.69) SLC6A2SLC6A4SLC6A3
SCHEMBL5793582 0.77 SLC6A2 (0.69) SLC6A2SLC6A4SLC6A3
SCHEMBL4485584 0.76 SLC6A2 (0.65) SLC6A2SLC6A4SLC6A3
SCHEMBL4489401 0.75 SLC6A2 (0.86) SLC6A2SLC6A4SLC6A3
SCHEMBL4493203 0.75 SLC6A2 (0.86) SLC6A2SLC6A4SLC6A3
SCHEMBL4486181 0.75 SLC6A2 (0.86) 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-1638934-A1 3-AMINOPYRROLIDINES AS INHIBITORS OF MONOAMINE UPTAKE ELI LILLY AND COMPANY (US) 2006-03-29 EP disclosed
WO-2005000811-A1 3-AMINOPYRROLIDINES AS INHIBITORS OF MONOAMINE UPTAKE ELI LILLY AND COMPANY (US) 2005-01-06 WO disclosed