SCHEMBL6863822

SCHEMBL6863822

Nc1nc2[nH]c(SCc3ccc(F)c(F)c3F)nc(=O)c2s1

nearest known ligand 0.56

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
CXCR2 P25025 15/20 0.56
CXCR1 P25024 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
SCHEMBL842322 0.90 CXCR2 (0.70) CXCR2CXCR1
SCHEMBL4236680 0.85 CXCR2 (0.57) CXCR2
SCHEMBL6863908 0.84 CXCR2 (0.56) CXCR2CXCR1
SCHEMBL6865137 0.81 HPGD (0.50) CXCR2
SCHEMBL6866799 0.78 CXCR2 (0.47) CXCR2
SCHEMBL6868880 0.78 CXCR2 (0.47) CXCR2
SCHEMBL6866758 0.78 MEN1 (0.57) CXCR2
SCHEMBL6868931 0.78 CXCR2 (0.47) CXCR2
SCHEMBL6864099 0.78 CXCR2 (0.46) CXCR2
SCHEMBL6997947 0.77 CXCR2 (0.56) CXCR2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6806273-B1 5-THIO-THIAZOLO(4,5-D)PYRIMIDIN-7-YL DERIVATIVES; CHEMOKINE RECEPTOR (ESPECIALLY CXCR2) ACTIVITY MODULATORS ASTRAZENECA AB (SE) 2004-10-19 US claimed
EP-1104425-B1 NOVEL THIAZOLOPYRIMIDINE COMPOUNDS ASTRAZENECA AB (SE) 2003-01-29 EP claimed
US-6806273-B1 5-THIO-THIAZOLO(4,5-D)PYRIMIDIN-7-YL DERIVATIVES; CHEMOKINE RECEPTOR (ESPECIALLY CXCR2) ACTIVITY MODULATORS ASTRAZENECA AB (SE) 2004-10-19 US disclosed
EP-1104425-B1 NOVEL THIAZOLOPYRIMIDINE COMPOUNDS ASTRAZENECA AB (SE) 2003-01-29 EP disclosed