SCHEMBL6185920

SCHEMBL6185920

COc1nc(Br)cnc1NS(=O)(=O)C1=CC(Cl)=CCC1=S

nearest known ligand 0.56

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
CCR4 P51679 16/20 0.56
CCR5 P51681 1/20 0.54
EDNRA P25101 4/20 0.48

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
SCHEMBL6181486 0.91 CCR4 (0.57) CCR4CCR5EDNRA
SCHEMBL6183754 0.89 CCR4 (0.54) CCR4CCR5EDNRA
SCHEMBL6183556 0.89 CCR4 (0.53) CCR4CCR5EDNRA
SCHEMBL6184365 0.89 CCR4 (0.55) CCR4CCR5EDNRA
SCHEMBL6182333 0.89 CCR4 (0.46) CCR4CCR5EDNRA
SCHEMBL6185821 0.86 CCR4 (0.45) CCR4CCR5EDNRA
SCHEMBL6182011 0.85 CCR4 (0.37) CCR4CCR5EDNRA
SCHEMBL6184018 0.85 CCR4 (0.46) CCR4CCR5EDNRA
SCHEMBL6182007 0.85 CCR4 (0.46) CCR4CCR5EDNRA
SCHEMBL6181508 0.84 CCR5 (0.50) CCR4CCR5

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-1458715-B1 NOVEL COMPOUNDS ASTRAZENECA AB (SE) 2005-12-07 EP claimed