SCHEMBL31531182

SCHEMBL31531182

CN(C)C(=O)c1nccc(Nc2c(NC3c4ccccc4CCC3(C)C)c(=O)c2=O)c1O

nearest known ligand 0.73

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ CCR6 P51684 17/20 0.73
▸ CXCR2 P25025 3/20 0.51
▸ CCR7 P32248 1/20 0.47

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
SCHEMBL31531067 1.00 CCR6 (0.73) CCR6CXCR2CCR7
SCHEMBL31531249 1.00 CCR6 (0.73) CCR6CXCR2CCR7
SCHEMBL31531188 0.90 CCR6 (0.59) CCR6CXCR2CCR7
SCHEMBL31531150 0.90 CCR6 (0.59) CCR6CXCR2CCR7
SCHEMBL31531160 0.90 CCR6 (0.59) CCR6CXCR2CCR7
SCHEMBL31531127 0.89 CCR6 (0.58) CCR6CXCR2CCR7
SCHEMBL31531154 0.86 CCR6 (0.57) CCR6CXCR2CCR7
SCHEMBL31531116 0.86 CCR6 (0.74) CCR6CXCR2CCR7
SCHEMBL31531161 0.86 CCR6 (0.74) CCR6CXCR2CCR7
SCHEMBL31531066 0.86 CCR6 (0.74) CCR6CXCR2CCR7

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-2025092968-A1 COMPOUND AS CCR6 ANTAGONIST, AND PHARMACEUTICAL COMPOSITION AND USE THEREOF 武汉朗来科技发展有限公司 2025-05-08 — — WO disclosed
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