SCHEMBL4627138

SCHEMBL4627138

O=C(O)C(c1ccc(Cl)c(Cl)c1)C1CCC1

nearest known ligand 0.65

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
SLC6A3 Q01959 16/20 0.65
SLC6A2 P23975 7/20 0.57
SLC6A4 P31645 7/20 0.57

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
SCHEMBL1565214 0.97 SLC6A3 (0.69) SLC6A3SLC6A2SLC6A4
SCHEMBL1565823 0.95 SLC6A3 (0.70) SLC6A3SLC6A2SLC6A4
SCHEMBL10898486 0.83 SLC6A3 (0.46) SLC6A3SLC6A2SLC6A4
SCHEMBL17847010 0.83 SLC6A3 (0.53) SLC6A3SLC6A2SLC6A4
SCHEMBL9942184 0.80 SLC6A3 (0.64) SLC6A3SLC6A2SLC6A4
SCHEMBL1565129 0.80 SLC6A3 (0.60) SLC6A3SLC6A2SLC6A4
SCHEMBL10006175 0.79 SLC6A3 (1.00) SLC6A3SLC6A2SLC6A4
SCHEMBL1565904 0.78 MEN1 (0.47) SLC6A3SLC6A2SLC6A4
SCHEMBL6070325 0.77 SLC6A3 (0.73) SLC6A3SLC6A2SLC6A4
SCHEMBL5903476 0.77 SLC6A3 (0.73) 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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1687288-B1 SUBSTITUTED ARYL CYCLOALKANOL DERIVATIVES AND METHODS OF THEIR USE WYETH CORP (US) 2008-01-16 EP disclosed