SCHEMBL15327342

SCHEMBL15327342

CC(C)(C)OC(=O)ON1C[C@H](S(=O)(=O)c2ccc(Cl)cc2Cl)C[C@H]1C(=O)NC1(C#N)CC1

nearest known ligand 0.56

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
CTSS P25774 18/20 0.56
CTSL P07711 15/20 0.56
CTSB P07858 3/20 0.56
CTSK P43235 2/20 0.52

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
SCHEMBL15327566 0.93 CTSS (0.60) CTSSCTSLCTSB
SCHEMBL15327279 0.92 CTSS (0.51) CTSSCTSLCTSB
SCHEMBL15327150 0.92 CTSS (0.61) CTSSCTSLCTSBCTSK
SCHEMBL15327344 0.89 CTSS (0.55) CTSSCTSLCTSB
SCHEMBL15327356 0.88 CTSS (0.64) CTSSCTSLCTSB
SCHEMBL15327624 0.88 CTSS (0.59) CTSSCTSLCTSB
SCHEMBL15327158 0.88 CTSS (0.56) CTSSCTSLCTSB
SCHEMBL15327641 0.88 CTSS (0.52) CTSSCTSLCTSB
SCHEMBL15327321 0.88 CTSS (0.57) CTSSCTSLCTSBCTSK
SCHEMBL15327300 0.88 CTSS (0.65) CTSSCTSLCTSK

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