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
SCHEMBL7345907 0.76 REN (0.51) RENCTSDPGA5CTSEPGC
SCHEMBL7345901 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
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