SCHEMBL15327264

SCHEMBL15327264

CC(C)(C)C(=O)N1C[C@H](S(=O)(=O)c2ccccc2Cl)C[C@@H]1OC(=O)NC1(C#N)CC1

nearest known ligand 0.66

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
CTSS P25774 17/20 0.66
CTSL P07711 6/20 0.66
CTSB P07858 3/20 0.66

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
SCHEMBL15327153 0.93 CTSS (0.63) CTSSCTSLCTSB
SCHEMBL15327160 0.92 CTSS (0.75) CTSSCTSLCTSB
SCHEMBL15327403 0.90 CTSS (0.62) CTSSCTSLCTSB
SCHEMBL15327504 0.90 CTSS (0.54) CTSSCTSLCTSB
SCHEMBL15327159 0.89 CTSS (0.65) CTSSCTSLCTSB
SCHEMBL15327399 0.89 CTSS (0.65) CTSSCTSLCTSB
SCHEMBL15327616 0.89 CTSS (0.75) CTSSCTSLCTSB
SCHEMBL15327272 0.88 CTSS (0.59) CTSSCTSLCTSB
SCHEMBL15327239 0.87 CTSS (0.65) CTSSCTSLCTSB
SCHEMBL15327176 0.86 CTSS (0.62) CTSSCTSLCTSB

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-2421826-B1 PROLINE DERIVATIVES AS CATHEPSIN INHIBITORS HOFFMANN LA ROCHE (CH) 2013-10-23 EP claimed