SCHEMBL13499183

SCHEMBL13499183

CC(=O)C[C@@H]1C(=O)NC=CN1S(=O)(=O)c1cccc(Cl)c1Cl

nearest known ligand 0.66

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
BDKRB1 P46663 20/20 0.66

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
SCHEMBL3535670 0.90 BDKRB1 (0.65) BDKRB1
SCHEMBL3535672 0.90 BDKRB1 (0.65) BDKRB1
SCHEMBL5502868 0.83 BDKRB1 (0.73) BDKRB1
SCHEMBL4697935 0.83 BDKRB1 (0.71) BDKRB1
SCHEMBL3534905 0.82 BDKRB1 (0.61) BDKRB1
SCHEMBL3539928 0.82 BDKRB1 (0.69) BDKRB1
SCHEMBL4174733 0.81 BDKRB1 (0.69) BDKRB1
SCHEMBL4176920 0.81 BDKRB1 (0.69) BDKRB1
SCHEMBL4180236 0.80 BDKRB1 (1.00) BDKRB1
SCHEMBL4173172 0.80 BDKRB1 (1.00) BDKRB1

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
US-7662811-B2 N-(((5R)-5-((1-methylethyl)amino)-5,6,7,8-tetrahydro-2-naphthalenyl)methyl)-2-((2R)-1-((4-methylphenyl)sulfonyl)-3-oxo-1,2,3,4-tetrahydro-2-pyrazinyl)acetamide; for treatment of pain and diseases, such as inflammation mediated diseases AMGEN INC. (US) 2010-02-16 US disclosed