SCHEMBL20760069

SCHEMBL20760069

CCC(C)(Nc1c(Nc2ccc(Cl)c(SN(C)C)c2O)c(=O)c1=O)c1ccccc1

nearest known ligand 0.69

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
▸ CCR6 P51684 20/20 0.69

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
SCHEMBL20760381 0.89 CCR6 (0.68) CCR6
SCHEMBL20761719 0.88 CCR6 (0.66) CCR6
SCHEMBL20760283 0.84 CCR6 (0.64) CCR6
SCHEMBL20746207 0.82 CCR6 (1.00) CCR6
SCHEMBL20721157 0.82 CCR6 (1.00) CCR6
SCHEMBL20721215 0.81 CCR6 (1.00) CCR6
SCHEMBL20721162 0.81 CCR6 (1.00) CCR6
SCHEMBL20746049 0.81 CCR6 (1.00) CCR6
SCHEMBL20760217 0.79 CXCR2 (0.56) CCR6
SCHEMBL20760085 0.78 CXCR2 (0.57) CCR6

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-2019036374-A1 3,4-DISUBSTITUTED 3-CYCLOBUTENE-1,2-DIONES AND USE THEREOF ALLERGAN, INC. (US) 2019-02-21 — — WO disclosed
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