SCHEMBL5730962

SCHEMBL5730962

CN1C2CCC1[C@@H](CO)[C@@H](c1ccc(F)cc1)C2

nearest known ligand 0.78

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
SLC6A3 Q01959 3/20 0.60
SLC6A2 P23975 1/20 0.60
SLC6A4 P31645 1/20 0.60

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
SCHEMBL27523486 1.00 SLC6A3 (0.60) SLC6A3SLC6A2SLC6A4
SCHEMBL2989416 1.00 SLC6A3 (0.60) SLC6A3SLC6A2SLC6A4
SCHEMBL5306199 1.00 SLC6A3 (0.60) SLC6A3SLC6A2SLC6A4
SCHEMBL8696563 1.00 SLC6A3 (0.60) SLC6A3SLC6A2SLC6A4
SCHEMBL6944840 1.00 SLC6A3 (0.60) SLC6A3SLC6A2SLC6A4
SCHEMBL6944834 1.00 SLC6A3 (0.60) SLC6A3SLC6A2SLC6A4
SCHEMBL2989418 1.00 SLC6A3 (0.60) SLC6A3SLC6A2SLC6A4
SCHEMBL6574577 1.00 SLC6A3 (0.60) SLC6A3SLC6A2SLC6A4
SCHEMBL6573763 1.00 SLC6A3 (0.60) SLC6A3SLC6A2SLC6A4
SCHEMBL6152741 0.87 SLC6A3 (0.65) 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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0905135-B1 Cocaine receptor binding ligands RES TRIANGLE INST (US) 2006-09-06 EP claimed
EP-0905135-A2 Cocaine receptor binding ligands RESEARCH TRIANGLE INSTITUTE (US) 1999-03-31 EP claimed
US-5496953-A DOPAMINE TRANSPORTER SITES, RADIOACTIVE, DIAGNOSIS, IMAGING, NORTROPANE DERIVATIVES RESEARCH TRIANGLE INSTITUTE (US) 1996-03-05 US disclosed
US-5380848-A 8-azabicyclo(3.2.1)octanes RESEARCH TRIANGLE INSTITUTE (US) 1995-01-10 US disclosed
WO-1993009814-A1 COCAINE RECEPTOR BINDING LIGANDS RESEARCH TRIANGLE INSTITUTE (US) 1993-05-27 WO disclosed