SCHEMBL4054795

SCHEMBL4054795

CCC(NC(C)=O)C(=O)N1CC(=O)C2C1CCN2C(=O)[CH]CC(C)C(N)=O

nearest known ligand 0.39

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
CTSK P43235 2/20 0.39

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
SCHEMBL4040440 0.93 CTSK (0.38) CTSK
SCHEMBL4047114 0.92 CTSK (0.48) CTSK
SCHEMBL4048903 0.91 CTSK (0.40) CTSK
SCHEMBL4046795 0.90 CTSK (0.41) CTSK
SCHEMBL4047635 0.89 PREP (0.38) CTSK
SCHEMBL4044235 0.89 CTSK (0.35) CTSK
SCHEMBL4050832 0.88 DPP4 (0.40) CTSK
SCHEMBL4046603 0.86 CTSK (0.39) CTSK
SCHEMBL4045682 0.86 CTSK (0.35) CTSK
SCHEMBL4052756 0.85 DPP4 (0.38) CTSK

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-1546150-B1 PYRROLE DERIVATIVES AS INHIBITORS OF CYTEINE PROTEASES AMURA THERAPEUTICS LTD (GB) 2009-03-04 EP claimed