SCHEMBL16735459

SCHEMBL16735459

CC1=C(S(N)(=O)=O)SC(c2ccccc2)N1c1cc(Cl)c(Cl)cc1NS(=O)(=O)c1cccs1

nearest known ligand 0.46

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
CCR2 P41597 15/20 0.46
BRAF P15056 1/20 0.43
MAPT P10636 2/20 0.41
HTT P42858 2/20 0.41
ALDH1A1 P00352 1/20 0.41
NPSR1 Q6W5P4 1/20 0.41
NPC1 O15118 1/20 0.40
MEN1 O00255 1/20 0.39
LMNA P02545 1/20 0.39
MAPK1 P28482 1/20 0.39
KMT2A Q03164 1/20 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
SCHEMBL16735482 0.87 CCR2 (0.49) CCR2BRAFMAPTHTTALDH1A1
SCHEMBL16735455 0.73 CCR2 (0.50) CCR2BRAFMAPTHTTALDH1A1
SCHEMBL16735481 0.72 CCR2 (0.51) CCR2BRAFMAPTHTTALDH1A1
SCHEMBL19415718 0.70 CCR2 (0.55) CCR2BRAF
SCHEMBL9930692 0.68 CCR2 (0.78) CCR2BRAFMAPTHTTMEN1
SCHEMBL16735456 0.68 CCR2 (0.51) CCR2BRAFMAPTHTTALDH1A1
SCHEMBL9936703 0.67 CCR2 (0.67) CCR2BRAFMAPTHTTMEN1
SCHEMBL7592227 0.67 CCR2 (0.67) CCR2BRAF
SCHEMBL9930439 0.67 CCR2 (0.71) CCR2BRAFMAPTHTTMEN1
SCHEMBL19415719 0.67 CCR2 (0.71) CCR2BRAFMAPTHTTMEN1

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2955173-B1 1,2-BIS-SULFONAMIDE DERIVATIVES AS CHEMOKINE RECEPTOR MODULATORS ALLERGAN INC (US) 2017-10-04 EP claimed
EP-2651901-B1 NOVEL 1,2- BIS-SULFONAMIDE DERIVATIVES AS CHEMOKINE RECEPTOR MODULATORS ALLERGAN INC (US) 2015-05-27 EP claimed