SCHEMBL6181508

SCHEMBL6181508

COc1nc(Cl)c(Cl)nc1NS(=O)(=O)C1=CC(Cl)=CCC1=S

nearest known ligand 0.50

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
CCR5 P51681 2/20 0.50
CCR4 P51679 19/20 0.39

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
SCHEMBL6181837 0.91 CCR5 (0.40) CCR5CCR4
SCHEMBL6183556 0.86 CCR4 (0.53) CCR5CCR4
SCHEMBL6183754 0.86 CCR4 (0.54) CCR5CCR4
SCHEMBL6182695 0.86 CCR4 (0.51) CCR5CCR4
SCHEMBL6185560 0.84 CCR4 (0.51) CCR5CCR4
SCHEMBL6185920 0.84 CCR4 (0.56) CCR5CCR4
SCHEMBL6182007 0.82 CCR4 (0.46) CCR5CCR4
SCHEMBL6183980 0.80 EDNRA (0.44) CCR5CCR4
SCHEMBL6185446 0.78 CCR4 (0.38) CCR5CCR4
SCHEMBL6183656 0.76 CCR4 (0.53) CCR5CCR4

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