SCHEMBL5583515

SCHEMBL5583515

CC(=O)Nc1c(C)cccc1OCC(O)CN(Cc1ccc(Cl)c(Cl)c1)C1CCNCC1

nearest known ligand 0.42

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.42
SLC6A2 P23975 16/20 0.41
SLC6A4 P31645 14/20 0.41
SLC6A3 Q01959 11/20 0.41
HTR6 P50406 1/20 0.40
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
SCHEMBL5583487 0.89 SLC6A2 (0.49) LMNASLC6A2SLC6A4SLC6A3NPSR1
SCHEMBL5583534 0.81 SLC6A2 (0.41) LMNASLC6A2SLC6A4SLC6A3NPSR1
SCHEMBL7264055 0.81 ABCB11 (0.47) LMNASLC6A2SLC6A4SLC6A3
SCHEMBL5583317 0.80 SLC6A2 (0.40) SLC6A2SLC6A4SLC6A3
SCHEMBL5583488 0.76 ABCB11 (0.46) LMNASLC6A2SLC6A4SLC6A3
SCHEMBL7268791 0.76 SLC6A2 (0.52) LMNASLC6A2SLC6A4SLC6A3
SCHEMBL4509250 0.75 ABCB11 (0.47) LMNASLC6A2SLC6A4SLC6A3
SCHEMBL5583444 0.72 SLC6A2 (0.43) LMNASLC6A2SLC6A4SLC6A3NPSR1
SCHEMBL5583474 0.72 TACR1 (0.47) SLC6A2SLC6A4SLC6A3
SCHEMBL5583417 0.71 ABCB11 (0.48) LMNASLC6A2SLC6A4SLC6A3HTR6

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