SCHEMBL6566471

SCHEMBL6566471

NCCCNS(=O)(=O)c1c(Cl)ccc(NC(=O)Nc2cccc(Cl)c2Cl)c1O

nearest known ligand 0.67

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
CXCR2 P25025 20/20 0.67
CX3CR1 P49238 1/20 0.67
CXCR1 P25024 1/20 0.49

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
SCHEMBL6566318 0.94 CXCR2 (0.69) CXCR2CX3CR1CXCR1
Trifluoroacetic Acid SCHEMBL4587053 0.93 CXCR2 (0.59) CXCR2CX3CR1
SCHEMBL6565712 0.88 CXCR2 (0.68) CXCR2CX3CR1CXCR1
SCHEMBL5436708 0.88 CXCR2 (0.65) CXCR2CX3CR1
Trifluoroacetic Acid SCHEMBL6562135 0.87 CXCR2 (0.61) CXCR2CX3CR1
SCHEMBL4587185 0.87 CXCR2 (0.73) CXCR2CX3CR1
SCHEMBL4587762 0.87 CXCR2 (0.64) CXCR2CX3CR1
SCHEMBL6564942 0.86 CXCR2 (0.69) CXCR2CX3CR1CXCR1
SCHEMBL5437226 0.86 CXCR2 (0.65) CXCR2CX3CR1CXCR1
Hydrochloric Acid SCHEMBL4588719 0.85 CXCR2 (0.67) CXCR2CX3CR1CXCR1

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 claimed