SCHEMBL6185560

SCHEMBL6185560

COc1nccnc1NS(=O)(=O)C1=CC(Cl)=CCC1=S

nearest known ligand 0.51

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
CCR4 P51679 8/20 0.51
MEN1 O00255 1/20 0.46
KMT2A Q03164 1/20 0.46
GAA P10253 2/20 0.41
ALDH1A1 P00352 5/20 0.39
MAPT P10636 2/20 0.39
ALOX12 P18054 3/20 0.37
HTT P42858 2/20 0.36
HPGD P15428 1/20 0.36
TDP1 Q9NUW8 1/20 0.36
CCR5 P51681 1/20 0.36
LMNA P02545 1/20 0.35
POLB P06746 1/20 0.35
NPSR1 Q6W5P4 1/20 0.35

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
SCHEMBL6182695 0.85 CCR4 (0.51) CCR4CCR5
SCHEMBL6183556 0.85 CCR4 (0.53) CCR4CCR5
SCHEMBL6183754 0.85 CCR4 (0.54) CCR4CCR5
SCHEMBL6181508 0.84 CCR5 (0.50) CCR4CCR5
SCHEMBL6185920 0.83 CCR4 (0.56) CCR4CCR5
SCHEMBL6181837 0.82 CCR5 (0.40) CCR4CCR5
SCHEMBL6182007 0.81 CCR4 (0.46) CCR4CCR5
SCHEMBL6183411 0.80 USP2 (0.35) CCR4GAAALDH1A1MAPTPOLB
SCHEMBL6183980 0.79 EDNRA (0.44) CCR4CCR5
SCHEMBL6185446 0.77 CCR4 (0.38) 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