SCHEMBL24876166

SCHEMBL24876166

CN(CC(F)(F)F)C(=O)OC(C)(C)C

nearest known ligand 0.39

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
CA14 Q9ULX7 1/20 0.39
CACNA1G O43497 1/20 0.37
CACNA1B Q00975 1/20 0.37
CACNA1C Q13936 1/20 0.37
HDAC6 Q9UBN7 2/20 0.36
HDAC1 Q13547 1/20 0.36
HDAC2 Q92769 1/20 0.36
PDK2 Q15119 1/20 0.35
CTSK P43235 3/20 0.35
CTSD P07339 1/20 0.33
CTSL P07711 1/20 0.33
CTSB P07858 1/20 0.33
CTSS P25774 1/20 0.33
HTR2C P28335 2/20 0.31
SLC6A4 P31645 2/20 0.31
DGAT1 O75907 1/20 0.30
L3MBTL1 Q9Y468 1/20 0.30
ASGR1 P07306 1/20 0.30

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
SCHEMBL30192795 0.86 HDAC6 (0.37) CA14CACNA1GCACNA1BCACNA1CHDAC6
SCHEMBL14443433 0.83 HDAC6 (0.38) CA14CACNA1GCACNA1BCACNA1CHDAC6
SCHEMBL19137112 0.82 CA14 (0.38) CA14CACNA1GCACNA1BCACNA1CHDAC6
SCHEMBL25901849 0.80 CA14 (0.35) CA14CACNA1GCACNA1BCACNA1CHDAC6
SCHEMBL20934891 0.80 CA14 (0.35) CA14CACNA1GCACNA1BCACNA1CHDAC6
SCHEMBL23945796 0.80 CA14 (0.35) CA14CACNA1GCACNA1BCACNA1CHDAC6
SCHEMBL25901934 0.80 CA14 (0.35) CA14CACNA1GCACNA1BCACNA1CHDAC6
SCHEMBL15584545 0.79 HDAC6 (0.38) CA14CACNA1GCACNA1BCACNA1CHDAC6
SCHEMBL15511200 0.79 DGAT1 (0.44) CA14CACNA1GCACNA1BCACNA1CHDAC6
SCHEMBL29799337 0.78 HDAC6 (0.38) CA14CACNA1GCACNA1BCACNA1CHDAC6

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-2023283453-A1 PHENYL ACETAMIDE BASED IL-17A MODULATORS AND USES THEREOF DICE ALPHA, INC. (US) 2023-01-12 WO disclosed