SCHEMBL13494868

SCHEMBL13494868

CNc1c(Nc2ccc(Cl)c(S(=O)(=O)N(C)OC)c2O)c(=O)c1=O

nearest known ligand 0.63

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ CXCR2 P25025 1/20 0.63
▸ CCR6 P51684 19/20 0.60

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
SCHEMBL15435085 0.88 CXCR2 (0.63) CXCR2CCR6
SCHEMBL2294988 0.88 CXCR2 (0.68) CXCR2CCR6
SCHEMBL13494867 0.87 CXCR2 (0.59) CXCR2CCR6
SCHEMBL2297462 0.86 CXCR2 (0.66) CXCR2CCR6
SCHEMBL15435012 0.86 CXCR2 (0.61) CXCR2CCR6
SCHEMBL2292593 0.86 CXCR2 (0.66) CXCR2CCR6
SCHEMBL2298432 0.86 CCR6 (0.74) CXCR2CCR6
SCHEMBL2299220 0.86 CXCR2 (0.66) CXCR2CCR6
SCHEMBL2293989 0.86 CXCR2 (0.74) CXCR2CCR6
SCHEMBL29423478 0.86 CXCR2 (0.74) CXCR2CCR6

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
WO-2010015613-A1 ORGANIC COMPOUNDS NOVARTIS AG (CH) 2010-02-11 — — WO disclosed
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