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SCHEMBL15327337

SCHEMBL15327337

Cc1cc(N2C[C@H](S(=O)(=O)c3ccc(OCC(F)(F)F)cc3Cl)C[C@@H]2OC(=O)NC2(C#N)CC2)n(CCc2ccccc2)n1

nearest known ligand 0.51

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ CTSS P25774 20/20 0.51
▸ CTSL P07711 16/20 0.51

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
SCHEMBL695686 0.91 CTSS (0.58) CTSSCTSL
SCHEMBL15327369 0.89 CTSS (0.49) CTSSCTSL
SCHEMBL15327385 0.88 CTSS (0.47) CTSSCTSL
SCHEMBL15327320 0.88 CTSS (0.47) CTSSCTSL
SCHEMBL15327155 0.86 CTSS (0.43) CTSSCTSL
SCHEMBL15327207 0.85 CTSS (0.53) CTSSCTSL
SCHEMBL15327261 0.85 CTSS (0.42) CTSSCTSL
SCHEMBL15327371 0.85 CTSS (0.48) CTSSCTSL
SCHEMBL15327435 0.84 CTSS (0.52) CTSSCTSL
SCHEMBL15327447 0.83 CTSS (0.37) CTSSCTSL

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