SCHEMBL5572662

SCHEMBL5572662

CC(CNC(=O)O)Oc1cc(Cl)nc(SCc2cccc(F)c2F)n1

nearest known ligand 0.46

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
CXCR2 P25025 16/20 0.46
CXCR1 P25024 1/20 0.46
ADORA3 P0DMS8 3/20 0.41
CCR7 P32248 2/20 0.41
RXRA P19793 1/20 0.41
RXRB P28702 1/20 0.41
RXRG P48443 1/20 0.41
PPARA Q07869 1/20 0.41

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
SCHEMBL5572655 1.00 CXCR2 (0.46) CXCR2CXCR1ADORA3CCR7RXRA
SCHEMBL1487377 0.84 CXCR2 (0.49) CXCR2CXCR1CCR7
SCHEMBL1487129 0.83 CXCR2 (0.47) CXCR2CXCR1CCR7RXRARXRB
SCHEMBL5569651 0.83 CXCR2 (0.47) CXCR2CXCR1CCR7RXRARXRB
SCHEMBL1487135 0.83 CXCR2 (0.47) CXCR2CXCR1CCR7RXRARXRB
SCHEMBL1487350 0.82 CXCR2 (0.45) CXCR2CXCR1CCR7
SCHEMBL5569979 0.82 CXCR2 (0.54) CXCR2CXCR1CCR7
SCHEMBL1487098 0.82 CXCR2 (0.54) CXCR2CXCR1CCR7
SCHEMBL1487190 0.82 CXCR2 (0.54) CXCR2CXCR1CCR7
SCHEMBL1487119 0.82 CXCR2 (0.42) CXCR2CXCR1ADORA3CCR7RXRA

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-1809624-A1 PYRIMIDINE SULPHONAMIDE DERIVATIVES AS CHEMOKINE RECEPTOR MODULATORS AstraZeneca AB (SE) 2007-07-25 EP disclosed
WO-2006024823-A1 PYRIMIDINE SULPHONAMIDE DERIVATIVES AS CHEMOKINE RECEPTOR MODULATORS ASTRAZENECA AB (SE) 2006-03-09 WO disclosed