SCHEMBL3164178

SCHEMBL3164178

Cc1ccc(C=CC(=O)N[C@@H](CCCNC(=N)N[N+](=O)[O-])C(=O)N[C@@H](CC(C)C)B(O)O)cc1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.38
MAPK1 P28482 1/20 0.38
TDP1 Q9NUW8 1/20 0.38
BACE1 P56817 1/20 0.37
CLPP Q16740 4/20 0.37
NOS3 P29474 3/20 0.36
NOS1 P29475 3/20 0.36
NOS2 P35228 3/20 0.36
TAS1R3 Q7RTX0 2/20 0.36
TAS1R1 Q7RTX1 2/20 0.36
PSMB5 P28074 3/20 0.36
PSMB1 P20618 2/20 0.36
PSMB2 P49721 2/20 0.36
LONP1 P36776 1/20 0.36
LMNA P02545 1/20 0.36
APEX1 P27695 1/20 0.35
MEN1 O00255 1/20 0.34
KMT2A Q03164 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
L3MBTL1 Q9Y468 1/20 0.34

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
SCHEMBL12754545 1.00 MAPT (0.38) MAPTMAPK1TDP1BACE1CLPP
SCHEMBL12754450 0.93 BACE1 (0.37) MAPTBACE1CLPPNOS3NOS1
SCHEMBL3155402 0.91 ALDH1A1 (0.40) MAPTCLPPPSMB5PSMB1PSMB2
SCHEMBL15291187 0.89 NOS3 (0.39) BACE1CLPPNOS3NOS1NOS2
SCHEMBL3168342 0.88 PSMB5 (0.42) CLPPPSMB5PSMB1PSMB2
SCHEMBL608977 0.87 MAPT (0.39) MAPTMAPK1TDP1NOS3NOS1
SCHEMBL12754443 0.85 LONP1 (0.36) CLPPPSMB5PSMB1PSMB2LONP1
SCHEMBL3164560 0.85 PSMB5 (0.38) CLPPNOS3NOS1NOS2PSMB5
SCHEMBL10245061 0.85 SMN1; SMN2 (0.41) MAPTMAPK1CLPPTAS1R3TAS1R1
SCHEMBL608976 0.84 LMNA (0.39) MAPTMAPK1TDP1NOS3NOS1

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