SCHEMBL5583534

SCHEMBL5583534

CNC(=O)c1ccccc1OCC(O)CN(Cc1ccc(Cl)c(Cl)c1)C1CCNCC1

nearest known ligand 0.41

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
SLC6A2 P23975 16/20 0.41
SLC6A4 P31645 15/20 0.41
SLC6A3 Q01959 8/20 0.41
ABCB1 P08183 2/20 0.40
LMNA P02545 1/20 0.40
POLB P06746 1/20 0.38
NPSR1 Q6W5P4 1/20 0.38

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
SCHEMBL5583444 0.91 SLC6A2 (0.43) SLC6A2SLC6A4SLC6A3ABCB1LMNA
SCHEMBL5583296 0.88 SLC6A2 (0.52) SLC6A2SLC6A4SLC6A3LMNA
SCHEMBL5583432 0.87 SLC6A2 (0.43) SLC6A2SLC6A4SLC6A3ABCB1LMNA
SCHEMBL5583317 0.84 SLC6A2 (0.40) SLC6A2SLC6A4SLC6A3
SCHEMBL5583515 0.81 LMNA (0.42) SLC6A2SLC6A4SLC6A3LMNANPSR1
SCHEMBL5583474 0.79 TACR1 (0.47) SLC6A2SLC6A4SLC6A3
SCHEMBL7264055 0.78 ABCB11 (0.47) SLC6A2SLC6A4SLC6A3LMNA
SCHEMBL5583469 0.77 SLC6A2 (0.40) SLC6A2SLC6A4SLC6A3LMNA
SCHEMBL5583421 0.76 SLC6A2 (0.43) SLC6A2SLC6A4SLC6A3ABCB1LMNA
SCHEMBL5583494 0.75 SLC6A2 (0.55) 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 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
JP-4022142-B2 2007-12-12 JP claimed
JP-2004507461-A 2004-03-11 JP claimed
EP-1299357-A1 NOVEL COMPOUNDS AstraZeneca AB (SE) 2003-04-09 EP claimed
WO-2001098273-A1 NOVEL COMPOUNDS ASTRAZENECA AB (SE) 2001-12-27 WO claimed
EP-1299357-A1 NOVEL COMPOUNDS AstraZeneca AB (SE) 2003-04-09 EP disclosed
WO-2001098273-A1 NOVEL COMPOUNDS ASTRAZENECA AB (SE) 2001-12-27 WO disclosed