SCHEMBL6450737

SCHEMBL6450737

CCOC(=O)N1CC[C@H](NS(=O)(=O)c2ccc(NC(=O)c3ccccc3C)c3ccccc23)C(CO)C1

nearest known ligand 0.75

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
CCR8 P51685 20/20 0.75

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
SCHEMBL1338269 1.00 CCR8 (0.75) CCR8
SCHEMBL1339765 1.00 CCR8 (0.75) CCR8
SCHEMBL12129385 1.00 CCR8 (0.75) CCR8
SCHEMBL6450747 1.00 CCR8 (0.75) CCR8
SCHEMBL1338271 1.00 CCR8 (0.75) CCR8
SCHEMBL12129389 0.95 CCR8 (0.77) CCR8
SCHEMBL1339947 0.95 CCR8 (0.77) CCR8
SCHEMBL1338754 0.95 CCR8 (0.77) CCR8
SCHEMBL1338752 0.95 CCR8 (0.77) CCR8
SCHEMBL1337863 0.90 CCR8 (0.78) CCR8

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-1581511-A1 CCR8 INHIBITORS MILLENNIUM PHARMACEUTICALS, INC. (US) 2005-10-05 EP disclosed
WO-2004058736-A1 CCR8 INHIBITORS MILLENNIUM PHARMACEUTICALS, INC. (US) 2004-07-15 WO disclosed