SCHEMBL27344128

SCHEMBL27344128

C#CCCCOC[C@H](NC(=O)OC(C)(C)C)C(=O)O

nearest known ligand 0.49

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
PPARA Q07869 5/20 0.49
PPARG P37231 4/20 0.47
CTSS P25774 9/20 0.42
CTSK P43235 8/20 0.42
ITGB3 P05106 1/20 0.41
ITGA2B P08514 1/20 0.41
CTSL P07711 1/20 0.40
CTSB P07858 1/20 0.40
ACE P12821 1/20 0.38
MEN1 O00255 1/20 0.38
GAA P10253 1/20 0.38
KMT2A Q03164 1/20 0.38
PPARD Q03181 2/20 0.37

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
SCHEMBL27343574 1.00 PPARA (0.49) PPARAPPARGCTSSCTSKITGB3
SCHEMBL22506799 0.83 PPARA (0.53) PPARAPPARGCTSSCTSKCTSL
SCHEMBL28462855 0.83 CTSK (0.51) PPARAPPARGCTSSCTSKITGB3
SCHEMBL12265061 0.83 PPARA (0.53) PPARAPPARGCTSSCTSKCTSL
SCHEMBL4656416 0.83 CTSK (0.51) PPARAPPARGCTSSCTSKITGB3
SCHEMBL28462823 0.83 CTSK (0.51) PPARAPPARGCTSSCTSKITGB3
SCHEMBL25755528 0.83 PPARA (0.53) PPARAPPARGCTSSCTSKCTSL
SCHEMBL17393 0.83 PPARA (0.53) PPARAPPARGCTSSCTSKITGB3
SCHEMBL13365298 0.83 PPARA (0.53) PPARAPPARGCTSSCTSKITGB3
SCHEMBL805173 0.83 PPARA (0.53) PPARAPPARGCTSSCTSKITGB3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2024133834-A1 POLYPEPTIDES THE UNIVERSITY COURT OF THE UNIVERSITY OF GLASGOW (GB) 2024-06-27 WO disclosed