SCHEMBL6566637

SCHEMBL6566637

O=C(Nc1ccc(Cl)c(S(=O)(=O)NC2CC2)c1O)Nc1cccc(Cl)c1Cl.O=[N+]([O-])c1ccc(Cl)c(S(=O)(=O)NC2CC2)c1Cl

nearest known ligand 0.58

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
CXCR2 P25025 19/20 0.58
CX3CR1 P49238 1/20 0.55
IDH2 P48735 1/20 0.47

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
SCHEMBL4604152 0.89 CXCR2 (0.67) CXCR2CX3CR1
SCHEMBL6562616 0.85 CXCR2 (0.66) CXCR2CX3CR1
SCHEMBL4587287 0.81 CXCR2 (0.54) CXCR2CX3CR1IDH2
Hydrochloric Acid SCHEMBL7508535 0.80 CXCR2 (0.54) CXCR2CX3CR1
SCHEMBL6565738 0.80 KMT2A (0.48)
SCHEMBL6565908 0.78 MEN1 (0.46)
SCHEMBL6564188 0.77 NPC1 (0.58) CXCR2CX3CR1
SCHEMBL7114367 0.76 CXCR2 (0.69) CXCR2CX3CR1
SCHEMBL7502166 0.76 CXCR2 (0.47) CXCR2CX3CR1
SCHEMBL6565974 0.75 KMT2A (0.56)

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-1161232-B1 HYDROXY DIPHENYL UREA SULFONAMIDES AS IL-8 RECEPTOR ANTAGONISTS SMITHKLINE BEECHAM CORP (US) 2004-03-24 EP disclosed