SCHEMBL1036652

SCHEMBL1036652

COC(=O)C1CCN(C(=O)C(CCn2cccc2C#N)NS(=O)(=O)c2cccc3[nH]cc(Cl)c23)CC1.NS(=O)(=O)c1cccc2[nH]ccc12

nearest known ligand 0.68

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
CCR10 P46092 20/20 0.68

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
SCHEMBL1074837 0.93 CCR10 (0.65) CCR10
SCHEMBL1075179 0.90 CCR10 (0.84) CCR10
SCHEMBL4306293 0.86 CCR10 (0.67) CCR10
SCHEMBL1312751 0.85 CCR10 (0.77) CCR10
SCHEMBL13665913 0.85 CCR10 (0.51) CCR10
SCHEMBL1312138 0.83 CCR10 (0.67) CCR10
SCHEMBL1077336 0.82 CCR10 (0.90) CCR10
SCHEMBL1313068 0.82 CCR10 (0.84) CCR10
SCHEMBL1075791 0.82 CCR10 (0.64) CCR10
SCHEMBL29396251 0.82 CCR10 (1.00) 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 2 patents. 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
WO-2009126675-A1 2-SULFONYLAMINO-4-HETEROARYL BUTYRAMIDE ANTAGONISTS OF CCR10 BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2009-10-15 WO disclosed