SCHEMBL6375481

SCHEMBL6375481

CCCCCNC(=O)Nc1ccc(Cl)c(S(N)(=O)=O)c1O

nearest known ligand 0.57

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
CXCR2 P25025 8/20 0.57
CXCR1 P25024 2/20 0.57
CX3CR1 P49238 1/20 0.57
EPHX2 P34913 2/20 0.48
MAPT P10636 1/20 0.47
EPHX1 P07099 7/20 0.45
ALDH1A1 P00352 1/20 0.44
HTT P42858 1/20 0.44
CA2 P00918 1/20 0.43
POLB P06746 1/20 0.43

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
SCHEMBL4605221 0.91 CXCR2 (0.60) CXCR2CXCR1CX3CR1EPHX1ALDH1A1
SCHEMBL4607210 0.86 CXCR2 (0.63) CXCR2CXCR1CX3CR1
SCHEMBL6444067 0.81 CXCR2 (0.54) CXCR2CXCR1CX3CR1CA2
SCHEMBL4605886 0.80 CXCR2 (0.62) CXCR2CXCR1CX3CR1MAPTCA2
SCHEMBL4604578 0.79 HTT (0.56) CXCR2CXCR1CX3CR1ALDH1A1HTT
SCHEMBL4588234 0.78 CXCR2 (0.59) CXCR2CXCR1CX3CR1HTT
SCHEMBL4604026 0.78 CXCR2 (0.59) CXCR2CXCR1CX3CR1
SCHEMBL4604688 0.78 CXCR2 (0.56) CXCR2CXCR1CX3CR1CA2
SCHEMBL4357568 0.77 EPHX1 (0.58) CXCR2EPHX2MAPTEPHX1ALDH1A1
SCHEMBL4603360 0.77 CXCR2 (0.58) CXCR2CXCR1CX3CR1CA2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1265603-A4 IL-8 RECEPTOR ANTAGONISTS SMITHKLINE BEECHAM CORP (US) 2005-09-28 EP claimed
EP-1265603-A2 IL-8 RECEPTOR ANTAGONISTS SmithKline Beecham Corporation (US) 2002-12-18 EP claimed
WO-2001068570-A2 IL-8 RECEPTOR ANTAGONISTS SMITHKLINE BEECHAM CORPORATION (US) 2001-09-20 WO claimed
EP-1265603-A4 IL-8 RECEPTOR ANTAGONISTS SMITHKLINE BEECHAM CORP (US) 2005-09-28 EP disclosed
EP-1265603-A2 IL-8 RECEPTOR ANTAGONISTS SmithKline Beecham Corporation (US) 2002-12-18 EP disclosed
WO-2001068570-A2 IL-8 RECEPTOR ANTAGONISTS SMITHKLINE BEECHAM CORPORATION (US) 2001-09-20 WO disclosed