SCHEMBL13947784

SCHEMBL13947784

COc1ccc([C@H](NC2=NS(=O)(=O)N=C2Nc2cccc(C(=O)N(C)C)c2O)C(C)(C)C)cc1OC

nearest known ligand 0.51

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ CXCR2 P25025 19/20 0.51
▸ CXCR1 P25024 15/20 0.51
▸ CCR6 P51684 1/20 0.49
▸ CCR7 P32248 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
SCHEMBL13407251 1.00 CXCR2 (0.51) CXCR2CXCR1CCR6CCR7
SCHEMBL13947945 0.94 CXCR2 (0.51) CXCR2CXCR1CCR6CCR7
SCHEMBL13407348 0.92 CXCR2 (0.49) CXCR2CXCR1CCR6CCR7
SCHEMBL13407232 0.89 CXCR2 (0.53) CXCR2CXCR1CCR6
SCHEMBL13407234 0.89 CCR6 (0.54) CXCR2CXCR1CCR6CCR7
SCHEMBL13407252 0.88 CCR6 (0.51) CXCR2CXCR1CCR6CCR7
SCHEMBL13407231 0.87 CCR6 (0.49) CXCR2CXCR1CCR6CCR7
SCHEMBL13405688 0.86 CCR6 (0.66) CXCR2CXCR1CCR6CCR7
SCHEMBL13407346 0.85 CXCR2 (0.68) CXCR2CXCR1CCR6
SCHEMBL13407352 0.85 CCR6 (0.53) CXCR2CXCR1CCR6CCR7

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-1551818-B1 THIADIAZOLEDIOXIDES AND THIADIAZOLEOXIDES AS CXC- AND CC-CHEMOKINE RECEPTOR LIGANDS SCHERING CORP (US) 2009-02-04 — — EP disclosed
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