SCHEMBL3170187

SCHEMBL3170187

COCCOCC(=O)NCC(=O)NCCCC(NC(=N)N[N+](=O)[O-])C(=O)NC(CC(C)C)B1O[C@@H]2C[C@@H]3C[C@@H](C3(C)C)[C@]2(C)O1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PSMB5 P28074 19/20 0.51
PSMB1 P20618 14/20 0.51
PSMB11 A5LHX3 13/20 0.51
PSMA7 O14818 13/20 0.51
PSMA1 P25786 13/20 0.51
PSMA2 P25787 13/20 0.51
PSMA3 P25788 13/20 0.51
PSMA4 P25789 13/20 0.51
PSMB8 P28062 13/20 0.51
PSMB9 P28065 13/20 0.51
PSMA5 P28066 13/20 0.51
PSMB4 P28070 13/20 0.51
PSMB6 P28072 13/20 0.51
PSMB10 P40306 13/20 0.51
PSMB3 P49720 13/20 0.51
PSMB2 P49721 13/20 0.51
PSMA6 P60900 13/20 0.51
PSMA8 Q8TAA3 13/20 0.51
PSMB7 Q99436 13/20 0.51
PSMD11 O00231 12/20 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
SCHEMBL12754265 0.95 PSMB5 (0.50) PSMB5PSMB1PSMB11PSMA7PSMA1
SCHEMBL12754250 0.93 PSMB5 (0.52) PSMB5PSMB1PSMB11PSMA7PSMA1
SCHEMBL12754251 0.92 PSMB5 (0.51) PSMB5PSMB1PSMB11PSMA7PSMA1
SCHEMBL1477893 0.87 PSMB5 (0.53) PSMB5PSMB1PSMB11PSMA7PSMA1
SCHEMBL609081 0.87 PSMB5 (0.52) PSMB5PSMB1PSMB11PSMA7PSMA1
SCHEMBL608381 0.86 PSMB5 (0.53) PSMB5PSMB1PSMB11PSMA7PSMA1
SCHEMBL609290 0.85 PSMB5 (0.57) PSMB5PSMB1PSMB11PSMA7PSMA1
SCHEMBL3168312 0.84 PSMB5 (0.55) PSMB5PSMB1PSMB11PSMA7PSMA1
SCHEMBL1477637 0.84 PSMB5 (0.57) PSMB5PSMB1PSMB11PSMA7PSMA1
SCHEMBL3170548 0.84 PSMB5 (0.53) PSMB5PSMB1PSMB11PSMA7PSMA1

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-1660507-B9 PROTEASOME INHIBITORS AND METHODS OF USING THE SAME CEPHALON INC (US) 2010-03-24 EP claimed
EP-1660507-B1 PROTEASOME INHIBITORS AND METHODS OF USING THE SAME CEPHALON INC (US) 2009-08-05 EP claimed