SCHEMBL16735503

SCHEMBL16735503

NS(=O)(=O)c1cccc2c1N(c1cc(Cl)c(Cl)cc1NS(=O)(=O)c1cccs1)C(=O)CC2

nearest known ligand 0.48

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
CCR2 P41597 15/20 0.48
MAPT P10636 3/20 0.43
HTT P42858 2/20 0.43
ALDH1A1 P00352 2/20 0.43
NPSR1 Q6W5P4 1/20 0.43
BRAF P15056 1/20 0.41
PTGES2 Q9H7Z7 1/20 0.38
LMNA P02545 2/20 0.38
MEN1 O00255 1/20 0.38
MAPK1 P28482 1/20 0.38
KMT2A Q03164 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.37
TDP1 Q9NUW8 1/20 0.37

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
SCHEMBL16735513 0.78 CCR2 (0.48) CCR2MAPTHTTALDH1A1NPSR1
SCHEMBL9940180 0.76 CCR2 (0.51) CCR2MAPTHTTALDH1A1NPSR1
SCHEMBL16735464 0.74 CCR2 (0.48) CCR2MAPTHTTALDH1A1NPSR1
SCHEMBL19406111 0.73 CCR2 (0.61) CCR2MAPTHTTBRAFPTGES2
SCHEMBL16735462 0.70 CCR2 (0.51) CCR2
SCHEMBL9930601 0.69 CCR2 (0.61) CCR2MAPTHTTALDH1A1BRAF
SCHEMBL9968092 0.69 CCR2 (0.77) CCR2BRAFPTGES2MEN1KMT2A
SCHEMBL19406113 0.68 CCR2 (0.73) CCR2BRAFMEN1KMT2ASMN1; SMN2
SCHEMBL16735456 0.68 CCR2 (0.51) CCR2MAPTHTTALDH1A1NPSR1
SCHEMBL9930923 0.68 CCR2 (0.77) CCR2BRAFPTGES2

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