SCHEMBL20760382

SCHEMBL20760382

CN(C)Sc1c(Cl)ccc(Nc2c(NC3c4ccoc4CCC3(C)C)c(=O)c2=O)c1O

nearest known ligand 0.72

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
▸ CCR6 P51684 20/20 0.72

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
SCHEMBL20761213 0.87 CCR6 (0.72) CCR6
SCHEMBL20760163 0.85 CCR6 (0.72) CCR6
SCHEMBL20721254 0.84 CCR6 (1.00) CCR6
SCHEMBL20721144 0.84 CCR6 (1.00) CCR6
SCHEMBL20721145 0.84 CCR6 (1.00) CCR6
SCHEMBL20721159 0.83 CCR6 (1.00) CCR6
SCHEMBL20721158 0.83 CCR6 (1.00) CCR6
SCHEMBL20760264 0.82 CCR6 (0.71) CCR6
SCHEMBL20746093 0.79 CCR6 (1.00) CCR6
SCHEMBL30168121 0.78 CCR6 (1.00) 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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