SCHEMBL5568593

SCHEMBL5568593

CCCOc1cc(Cl)nc(SCc2cccc(F)c2F)n1

nearest known ligand 0.43

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
ADORA3 P0DMS8 2/20 0.43
CXCR2 P25025 16/20 0.42
CCR7 P32248 3/20 0.42
CXCR1 P25024 1/20 0.40
MEN1 O00255 1/20 0.39
KMT2A Q03164 1/20 0.39
MAPT P10636 1/20 0.39
ADORA1 P30542 1/20 0.38

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
SCHEMBL1487162 0.91 CXCR2 (0.44) CXCR2CCR7CXCR1MEN1KMT2A
SCHEMBL1487059 0.89 CXCR2 (0.45) CXCR2CCR7CXCR1
SCHEMBL1487341 0.88 CXCR2 (0.48) CXCR2CCR7CXCR1
SCHEMBL1487166 0.86 CXCR2 (0.44) CXCR2CCR7CXCR1MEN1KMT2A
SCHEMBL1487150 0.84 CXCR2 (0.40) CXCR2CCR7CXCR1MAPT
SCHEMBL1487377 0.83 CXCR2 (0.49) CXCR2CCR7CXCR1
SCHEMBL1487317 0.83 CXCR2 (0.43) CXCR2CCR7CXCR1MEN1KMT2A
SCHEMBL490032 0.83 CXCR2 (0.47) CXCR2CCR7MEN1KMT2A
SCHEMBL1487207 0.81 CXCR2 (0.45) CXCR2CCR7CXCR1
SCHEMBL1487098 0.79 CXCR2 (0.54) CXCR2CCR7CXCR1

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 3 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-A9 PYRIMIDINE SULPHONAMIDE DERIVATIVES AS CHEMOKINE RECEPTOR MODULATORS ASTRAZENECA AB (SE) 2007-03-15 WO disclosed
WO-2006024823-A1 PYRIMIDINE SULPHONAMIDE DERIVATIVES AS CHEMOKINE RECEPTOR MODULATORS ASTRAZENECA AB (SE) 2006-03-09 WO disclosed