SCHEMBL6184018

SCHEMBL6184018

O=S(=O)(Nc1ncc(Br)nc1Oc1ccccc1)C1=CC(Cl)=CCC1=S

nearest known ligand 0.46

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
CCR4 P51679 17/20 0.46
EDNRA P25101 3/20 0.42
CCR5 P51681 1/20 0.41

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
SCHEMBL6182011 0.81 CCR4 (0.37) CCR4EDNRACCR5
SCHEMBL6183980 0.77 EDNRA (0.44) CCR4EDNRACCR5
SCHEMBL5105623 0.74 CCR4 (0.72) CCR4EDNRACCR5
SCHEMBL6183754 0.74 CCR4 (0.54) CCR4EDNRACCR5
SCHEMBL6184365 0.74 CCR4 (0.55) CCR4EDNRACCR5
SCHEMBL6185560 0.73 CCR4 (0.51) CCR4CCR5
SCHEMBL6183411 0.72 USP2 (0.35) CCR4
SCHEMBL6182007 0.71 CCR4 (0.46) CCR4EDNRACCR5
SCHEMBL6182695 0.70 CCR4 (0.51) CCR4EDNRACCR5
SCHEMBL6180554 0.70 CCR4 (0.51) CCR4EDNRA

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