SCHEMBL1035787

SCHEMBL1035787

CCOC(=O)C1CCCN(C(=O)C(CCn2cccc2C#N)NS(=O)(=O)c2c(C)cccc2Cl)C1.CN(Cc1ccccc1)C(=O)C(CCn1cccc1C#N)NS(=O)(=O)c1cc(Cl)c(N)c(Cl)c1

nearest known ligand 0.61

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
CCR10 P46092 20/20 0.61

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
SCHEMBL1076802 0.86 CCR10 (0.59) CCR10
SCHEMBL1034928 0.82 CCR10 (0.50) CCR10
SCHEMBL1313791 0.82 CCR10 (0.64) CCR10
SCHEMBL4443310 0.80 CCR10 (0.62) CCR10
SCHEMBL13665650 0.79 CCR10 (0.49) CCR10
SCHEMBL1311277 0.78 CCR10 (0.49) CCR10
SCHEMBL1312034 0.78 CCR10 (0.53) CCR10
SCHEMBL1311347 0.77 CCR10 (0.48) CCR10
SCHEMBL1076908 0.77 CCR10 (1.00) CCR10
SCHEMBL1032234 0.77 CCR10 (0.73) CCR10

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-2276731-A1 2-SULFONYLAMINO-4-HETEROARYL BUTYRAMIDE ANTAGONISTS OF CCR10 Boehringer Ingelheim International GmbH (DE) 2011-01-26 EP disclosed