SCHEMBL15327591

SCHEMBL15327591

N#CC1(NC(=O)O[C@H]2C[C@@H](S(=O)(=O)c3ccc(Cl)cc3Cl)CN2C(=O)C2(c3ccc(Cl)cc3)CC2)CC1

nearest known ligand 0.66

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
CTSL P07711 20/20 0.66
CTSS P25774 16/20 0.57
CTSK P43235 3/20 0.54
CTSB P07858 2/20 0.50

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
SCHEMBL15327444 0.95 CTSL (0.64) CTSLCTSSCTSKCTSB
SCHEMBL15327421 0.94 CTSL (0.65) CTSLCTSSCTSKCTSB
SCHEMBL15327574 0.92 CTSL (0.79) CTSLCTSSCTSKCTSB
SCHEMBL15327468 0.91 CTSL (0.59) CTSLCTSSCTSKCTSB
SCHEMBL15327496 0.89 CTSL (0.57) CTSLCTSSCTSKCTSB
SCHEMBL15327305 0.89 CTSL (0.58) CTSLCTSS
SCHEMBL15327193 0.89 CTSL (0.57) CTSLCTSSCTSK
SCHEMBL15327189 0.89 CTSL (0.68) CTSLCTSSCTSKCTSB
SCHEMBL15327575 0.89 CTSS (0.54) CTSLCTSSCTSKCTSB
SCHEMBL15327461 0.88 CTSL (0.58) CTSLCTSSCTSK

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