SCHEMBL6828558

SCHEMBL6828558

CC(C)C[C@H](NS(=O)(=O)N1CCOCC1)C(=O)N[C@@H](Cc1ccccc1)C(=O)COP(=O)(O)O

nearest known ligand 0.57

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
REN P00797 20/20 0.57
CTSD P07339 2/20 0.52
PGA5 P0DJD9 2/20 0.52
CTSE P14091 2/20 0.52
PGC P20142 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
SCHEMBL7331287 0.82 REN (0.63) RENCTSDPGA5CTSEPGC
SCHEMBL6828559 0.79 CAPN1 (0.40)
SCHEMBL7385524 0.76 MEN1 (0.61) RENCTSDPGA5CTSEPGC
SCHEMBL7317104 0.76 MEN1 (0.61) RENCTSDPGA5CTSEPGC
SCHEMBL7345901 0.76 REN (0.51) RENCTSDPGA5CTSEPGC
SCHEMBL7345907 0.76 REN (0.51) RENCTSDPGA5CTSEPGC
SCHEMBL6828393 0.76 CAPN1 (0.63)
SCHEMBL6825437 0.75 REN (0.64) REN
SCHEMBL7336138 0.72 REN (0.51) RENCTSDPGA5CTSEPGC
SCHEMBL7331751 0.71 REN (0.54) RENCTSDPGA5CTSEPGC

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1389624-A1 Phosphorous-containing cysteine and serine protease inhibitors CEPHALON, INC. (US) 2004-02-18 EP disclosed
EP-0871454-B1 PHOSPHOROUS-CONTAINING CYSTEINE AND SERINE PROTEASE INHIBITORS CEPHALON INC (US) 2003-11-12 EP disclosed
EP-0871454-A4 1998-11-25 EP disclosed
EP-0871454-A1 PHOSPHOROUS-CONTAINING CYSTEINE AND SERINE PROTEASE INHIBITORS CEPHALON, INC. (US) 1998-10-21 EP disclosed
US-5639732-A FOR TREATING NERVOUS SYSTEM DISORDERS OR AS ANTIINFLAMMATORY AGENT CEPHALON, INC. (US) 1997-06-17 US disclosed
WO-1997003679-A1 PHOSPHOROUS-CONTAINING CYSTEINE AND SERINE PROTEASE INHIBITORS CEPHALON, INC. (US) 1997-02-06 WO disclosed