SCHEMBL8050344

SCHEMBL8050344

CC(C)(C)OC(=O)N[C@@H](Cc1cncn1C(=O)OC(C)(C)C)C(=O)NC(C)(C)C(=O)ON1C(=O)CCC1=O

nearest known ligand 0.34

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
SCN9A Q15858 11/20 0.34
AKT1 P31749 1/20 0.33
CTSS P25774 7/20 0.33
CTSK P43235 5/20 0.33
CTSB P07858 3/20 0.33
CTSL P07711 1/20 0.33
ACE P12821 1/20 0.32

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
SCHEMBL8054432 0.85 CTSS (0.40) AKT1CTSSCTSKCTSBCTSL
SCHEMBL6957298 0.78 ACE (0.50) SCN9ACTSSCTSKCTSBCTSL
SCHEMBL22403247 0.78 ACE (0.40) AKT1CTSSCTSKCTSBCTSL
SCHEMBL6950805 0.78 ACE (0.50) SCN9ACTSSCTSKCTSBCTSL
SCHEMBL13811785 0.72 ACE (0.36) CTSSCTSKCTSBCTSLACE
SCHEMBL406298 0.71 ATM (0.38) CTSSACE
SCHEMBL12330490 0.71 AAK1 (0.51) AKT1CTSSCTSKCTSBCTSL
SCHEMBL28046578 0.71 F10 (0.49)
SCHEMBL28046576 0.71 F10 (0.49)
SCHEMBL4761847 0.70 NFKB1 (0.35)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9732137-B2 Semi-recombinant preparation of GLP-1 analogues NOVO NORDISK A/S (DK) 2017-08-15 US disclosed
US-9732137-B2 Semi-recombinant preparation of GLP-1 analogues NOVO NORDISK A/S (DK) 2017-08-15 US disclosed
US-20100317057-A1 SEMI-RECOMBINANT PREPARATION OF GLP-1 ANALOGUES NOVO NORDISK A/S (DK) 2010-12-16 US disclosed
US-20100317057-A1 SEMI-RECOMBINANT PREPARATION OF GLP-1 ANALOGUES NOVO NORDISK A/S (DK) 2010-12-16 US disclosed
WO-2009083549-A1 SEMI-RECOMBINANT PREPARATION OF GLP-1 ANALOGUES NOVO NORDISK A/S (DK) 2009-07-09 WO disclosed