SCHEMBL6586362

SCHEMBL6586362

Cc1cccc(S(=O)(=O)N(C(=O)[CH]CC(C)C(N)=O)C2CCCNC[C@@H]2O)n1

nearest known ligand 0.31

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
IRAK4 Q9NWZ3 4/20 0.31

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
SCHEMBL6590523 0.91 SLC6A2 (0.30)
SCHEMBL5971336 0.87 IRAK4 (0.33) IRAK4
SCHEMBL6589694 0.84 SIGMAR1 (0.34) IRAK4
SCHEMBL4763246 0.84
SCHEMBL6590708 0.81 CHEK1 (0.30)
SCHEMBL6590069 0.81 ALDH1A1 (0.33) IRAK4
SCHEMBL6610142 0.81
SCHEMBL6586366 0.81 SLC6A2 (0.31) IRAK4
SCHEMBL6588480 0.79 IRAK4 (0.31) IRAK4
SCHEMBL6590526 0.78 REN (0.32)

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 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1307204-A4 PROTEASE INHIBITORS SMITHKLINE BEECHAM CORP (US) 2004-06-02 EP disclosed
EP-1307204-A1 PROTEASE INHIBITORS SmithKline Beecham Corporation (US) 2003-05-07 EP disclosed
EP-1158986-A4 PROTEASE INHIBITORS SMITHKLINE BEECHAM CORP (US) 2002-03-27 EP disclosed
WO-2001095911-A1 PROTEASE INHIBITORS SMITHKLINE BEECHAM CORPORATION (US) 2001-12-20 WO disclosed
EP-1158986-A1 PROTEASE INHIBITORS SmithKline Beecham Corporation (US) 2001-12-05 EP disclosed
WO-2000038687-A1 PROTEASE INHIBITORS SMITHKLINE BEECHAM CORPORATION (US) 2000-07-06 WO disclosed