SCHEMBL5554585

SCHEMBL5554585

CS(=O)(=O)CC1CCNC(=O)C1

nearest known ligand 0.31

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
NOS1 P29475 1/20 0.31
MKNK2 Q9HBH9 1/20 0.31
OPRL1 P41146 1/20 0.30
IRAK4 Q9NWZ3 1/20 0.30
PDCD1 Q15116 1/20 0.30
CD274 Q9NZQ7 1/20 0.30

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
SCHEMBL5451213 0.84
SCHEMBL13575606 0.84
SCHEMBL5554582 0.81
SCHEMBL5155505 0.80 MEN1 (0.33)
SCHEMBL16031581 0.77 IRAK4 (0.35) MKNK2IRAK4PDCD1CD274
SCHEMBL8299815 0.76
SCHEMBL16109535 0.74
SCHEMBL26064924 0.74
SCHEMBL19465901 0.73 OPRL1 (0.34) OPRL1IRAK4PDCD1CD274
SCHEMBL2526110 0.73 HTT (0.41) NOS1

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-1865940-A2 ALPHA KETOAMIDE COMPOUNDS AS CYSTEINE PROTEASE INHIBITORS Applera Corporation (US) 2007-12-19 EP disclosed
WO-2006102243-A2 ALPHA KETOAMIDE COMPOUNDS AS CYSTEINE PROTEASE INHIBITORS APPLERA CORPORATION (US) 2006-09-28 WO disclosed