SCHEMBL6186913

SCHEMBL6186913

Cc1cccc(CN(CC(C)C)C2CCNCC2)c1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
SLC6A2 P23975 20/20 1.00
SLC6A4 P31645 17/20 1.00
SLC6A3 Q01959 11/20 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
Fumaric Acid SCHEMBL5995714 0.90 SLC6A2 (1.00) SLC6A2SLC6A4SLC6A3
Fumaric Acid SCHEMBL5995719 0.90 SLC6A2 (1.00) SLC6A2SLC6A4SLC6A3
SCHEMBL5995526 0.86 SLC6A2 (0.76) SLC6A2SLC6A4SLC6A3
SCHEMBL5993744 0.86 SLC6A2 (0.75) SLC6A2SLC6A4SLC6A3
SCHEMBL5993839 0.86 SLC6A2 (1.00) SLC6A2SLC6A4SLC6A3
SCHEMBL5997599 0.86 SLC6A2 (0.75) SLC6A2SLC6A4SLC6A3
SCHEMBL5994946 0.85 SLC6A2 (1.00) SLC6A2SLC6A4SLC6A3
SCHEMBL5993049 0.85 SLC6A2 (0.78) SLC6A2SLC6A4SLC6A3
SCHEMBL5995292 0.84 SLC6A2 (1.00) SLC6A2SLC6A4SLC6A3
SCHEMBL5995491 0.84 SLC6A2 (1.00) 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-1569905-A2 INHIBITORS OF MONOAMINE UPTAKE ELI LILLY AND COMPANY (US) 2005-09-07 EP disclosed
WO-2004052858-A2 INHIBITORS OF MONOAMINE UPTAKE ELI LILLY AND COMPANY (US) 2004-06-24 WO disclosed