SCHEMBL8310589

SCHEMBL8310589

CC(=O)N[C@@H](CSC(=O)c1ccc(C(F)(F)F)cc1)C(=O)O

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PPARG P37231 2/20 0.49
▸ PPARA Q07869 2/20 0.49
▸ ACE P12821 1/20 0.46
▸ PTPN1 P18031 2/20 0.44
▸ NR4A1 P22736 1/20 0.41
▸ NR4A2 P43354 1/20 0.41
▸ NR4A3 Q92570 1/20 0.41
▸ HDAC3 O15379 1/20 0.41
▸ HDAC4 P56524 1/20 0.41
▸ HDAC1 Q13547 1/20 0.41
▸ HDAC7 Q8WUI4 1/20 0.41
▸ HDAC2 Q92769 1/20 0.41
▸ HDAC10 Q969S8 1/20 0.41
▸ HDAC11 Q96DB2 1/20 0.41
▸ HDAC8 Q9BY41 1/20 0.41
▸ HDAC6 Q9UBN7 1/20 0.41
▸ HDAC9 Q9UKV0 1/20 0.41
▸ HDAC5 Q9UQL6 1/20 0.41
▸ L3MBTL1 Q9Y468 1/20 0.41
▸ GSK3B P49841 1/20 0.41

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
SCHEMBL8310591 1.00 PPARG (0.49) PPARGPPARAACEPTPN1NR4A1
SCHEMBL8307913 0.85 TSHR (0.54) ACETSHRSMN1; SMN2CTSLPAM
SCHEMBL8307911 0.85 TSHR (0.54) ACETSHRSMN1; SMN2CTSLPAM
SCHEMBL16641857 0.83 ALDH1A1 (0.46) PPARGPPARAACEGSK3BLMNA
SCHEMBL16641859 0.83 ALDH1A1 (0.46) PPARGPPARAACEGSK3BLMNA
SCHEMBL8310917 0.83 GPR139 (0.51) PPARGPPARASMN1; SMN2PAM
SCHEMBL8310911 0.83 GPR139 (0.51) PPARGPPARASMN1; SMN2PAM
SCHEMBL1404293 0.82 ACE (0.40) PPARGPPARAACEL3MBTL1FPR2
SCHEMBL374424 0.82 ACE (0.40) PPARGPPARAACEL3MBTL1FPR2
SCHEMBL8308373 0.80 PPARG (0.48) PPARGPPARAACEHDAC3HDAC4

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
EP-0903346-A1 SYDNONE IMINE DERIVATIVES Chugai Seiyaku Kabushiki Kaisha (JP) 1999-03-24 — — EP disclosed
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