SCHEMBL5322350

SCHEMBL5322350

O=CCOC(Cc1ccccc1)C(=O)O

nearest known ligand 0.59

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
SRR Q9GZT4 2/20 0.59
PPARG P37231 17/20 0.51
PPARA Q07869 15/20 0.51
ACE P12821 1/20 0.50

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
SCHEMBL7301799 1.00 SRR (0.59) SRRPPARGPPARAACE
SCHEMBL16416739 0.87 SRR (0.51) SRRPPARGPPARA
SCHEMBL7331579 0.85 SRR (0.57) SRRPPARGPPARAACE
SCHEMBL6429518 0.80 SRR (0.65) SRRPPARGPPARA
SCHEMBL10798806 0.80 SRR (0.65) SRRPPARGPPARA
SCHEMBL3781159 0.80 SRR (0.65) SRRPPARGPPARA
SCHEMBL1670312 0.79 PPARA (0.69) SRRPPARGPPARA
SCHEMBL7394969 0.79 SRR (0.62) SRRPPARGPPARAACE
SCHEMBL9077889 0.79 SRR (0.62) SRRPPARGPPARAACE
SCHEMBL13925610 0.79 SRR (0.62) SRRPPARGPPARAACE

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-2007008156-A1 A PHARMACEUTICAL COMPOSITION COMPRISING A SUBSTITUTED PHENYLPROPIONIC ACID AS A FREE ACID AND AS TERT-BUTYL AMINE SALT THEREOF ASTRAZENECA AB (SE) 2007-01-18 WO disclosed