SCHEMBL8103650

SCHEMBL8103650

CC(C)C[C@H](NC(=O)c1ccc(-c2csc(N3CCN(C)CC3)n2)cc1)C(=O)N1C[C@@H](Cl)C2OCC(=O)C21

nearest known ligand 0.86

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
CTSK P43235 20/20 0.86
CTSS P25774 9/20 0.81
CTSL P07711 7/20 0.81

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
SCHEMBL1169417 1.00 CTSK (0.86) CTSKCTSSCTSL
SCHEMBL9909685 1.00 CTSK (0.86) CTSKCTSSCTSL
SCHEMBL8097951 1.00 CTSK (0.86) CTSKCTSSCTSL
SCHEMBL1169200 1.00 CTSK (0.86) CTSKCTSSCTSL
SCHEMBL3542954 0.92 CTSK (0.87) CTSKCTSSCTSL
SCHEMBL1479556 0.92 CTSK (1.00) CTSKCTSSCTSL
SCHEMBL3542958 0.92 CTSK (0.87) CTSKCTSSCTSL
SCHEMBL3547470 0.92 CTSK (0.87) CTSKCTSSCTSL
SCHEMBL1480368 0.92 CTSK (1.00) CTSKCTSSCTSL
SCHEMBL3547468 0.92 CTSK (0.87) CTSKCTSSCTSL

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
WO-2009000877-A1 CYSTEINE PROTEASE INHIBITORS MEDIVIR AB (SE) 2008-12-31 WO disclosed