SCHEMBL6574450

SCHEMBL6574450

CN1[C@@H]2CC[C@@H]1[C@@H](CO)[C@H](c1ccc(Cl)cc1)C2

nearest known ligand 0.80

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
SLC6A3 Q01959 8/20 0.80
SLC6A2 P23975 2/20 0.62
SLC6A4 P31645 2/20 0.62

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
SCHEMBL5307753 1.00 SLC6A3 (0.80) SLC6A3SLC6A2SLC6A4
SCHEMBL6574453 1.00 SLC6A3 (0.80) SLC6A3SLC6A2SLC6A4
SCHEMBL6576682 1.00 SLC6A3 (0.80) SLC6A3SLC6A2SLC6A4
SCHEMBL3000484 1.00 SLC6A3 (0.80) SLC6A3SLC6A2SLC6A4
SCHEMBL7347413 1.00 SLC6A3 (0.80) SLC6A3SLC6A2SLC6A4
SCHEMBL5731609 1.00 SLC6A3 (0.80) SLC6A3SLC6A2SLC6A4
SCHEMBL5731604 1.00 SLC6A3 (0.80) SLC6A3SLC6A2SLC6A4
SCHEMBL3000482 1.00 SLC6A3 (0.80) SLC6A3SLC6A2SLC6A4
SCHEMBL5731428 0.89 SLC6A3 (0.76) SLC6A3
SCHEMBL5731247 0.87 SLC6A3 (0.82) 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-1397358-A1 TROPANE DERIVATIVES AND THEIR USE AS MONOAMINE NEUROTRANSMITTER RE-UPTAKE INHIBITORS NEUROSEARCH A/S (DK) 2004-03-17 EP disclosed
WO-2002102801-A1 TROPANE DERIVATIVES AND THEIR USE AS MONOAMINE NEUROTRANSMITTER RE-UPTAKE INHIBITORS NEUROSEARCH A/S (DK) 2002-12-27 WO disclosed