SCHEMBL8369487

SCHEMBL8369487

N/C(=C(\F)[C@@H](CCc1ccccc1)C(=O)[C@H](Cc1ccccc1)NC(=O)N1CCOCC1)S(=O)(=O)c1ccccc1

nearest known ligand 0.56

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
CTSL P07711 8/20 0.56
CTSB P07858 8/20 0.56
CTSS P25774 13/20 0.53
CTSK P43235 3/20 0.48
CTSH P09668 1/20 0.48
CTSC P53634 1/20 0.48

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
SCHEMBL7360722 0.90 CTSL (0.56) CTSLCTSBCTSSCTSKCTSH
SCHEMBL7414183 0.78 CTSL (0.59) CTSLCTSBCTSSCTSKCTSH
SCHEMBL7400251 0.78 CTSL (0.73) CTSLCTSBCTSSCTSKCTSH
SCHEMBL7400248 0.78 CTSL (0.73) CTSLCTSBCTSSCTSKCTSH
SCHEMBL7400246 0.78 CTSL (0.73) CTSLCTSBCTSSCTSKCTSH
SCHEMBL6449419 0.76 CTSB (0.67) CTSLCTSBCTSSCTSKCTSH
SCHEMBL8696030 0.75 CTSL (0.70) CTSLCTSBCTSSCTSKCTSH
SCHEMBL7414216 0.75 CTSL (0.70) CTSLCTSBCTSSCTSKCTSH
SCHEMBL8696034 0.75 CTSL (0.70) CTSLCTSBCTSSCTSKCTSH
SCHEMBL7414213 0.75 CTSL (0.70) CTSLCTSBCTSSCTSKCTSH

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0756625-A4 IRREVERSIBLE CYSTEINE PROTEASE INHIBITORS CONTAINING VINYL GROUPS CONJUGATED TO ELECTRON WITHDRAWING GROUPS ARRIS PHARM CORP (US) 1999-07-28 EP disclosed
EP-0756625-A1 IRREVERSIBLE CYSTEINE PROTEASE INHIBITORS CONTAINING VINYL GROUPS CONJUGATED TO ELECTRON WITHDRAWING GROUPS ARRIS PHARMACEUTICAL CORPORATION (US) 1997-02-05 EP disclosed