SCHEMBL5024641

SCHEMBL5024641

CCOC(C(=O)OC)C(O)c1ccc(OCc2ccccc2)cc1OC

nearest known ligand 0.50

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
FFAR1 O14842 4/20 0.50
LTA4H P09960 2/20 0.46
L3MBTL1 Q9Y468 2/20 0.44
LMNA P02545 2/20 0.44
PPARA Q07869 2/20 0.43
PPARG P37231 1/20 0.43
PPARD Q03181 1/20 0.43
MAOB P27338 2/20 0.43
ALDH1A1 P00352 1/20 0.42
EPOR P19235 1/20 0.42
BCHE P06276 1/20 0.41
KDM4E B2RXH2 1/20 0.41
HPGD P15428 1/20 0.41
KMT2A Q03164 1/20 0.41
NPC1 O15118 1/20 0.41
RAB9A P51151 1/20 0.41
SMN1; SMN2 Q16637 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
SCHEMBL5024649 1.00 FFAR1 (0.50) FFAR1LTA4HL3MBTL1LMNAPPARA
SCHEMBL3369824 1.00 FFAR1 (0.50) FFAR1LTA4HL3MBTL1LMNAPPARA
SCHEMBL3371178 0.88 LTA4H (0.47) FFAR1LTA4HL3MBTL1LMNAPPARA
SCHEMBL6533050 0.88 LTA4H (0.47) FFAR1LTA4HL3MBTL1LMNAPPARA
SCHEMBL3373968 0.88 LMNA (0.47) FFAR1LTA4HL3MBTL1LMNAPPARA
SCHEMBL3373966 0.88 LMNA (0.47) FFAR1LTA4HL3MBTL1LMNAPPARA
SCHEMBL3369977 0.88 LMNA (0.47) FFAR1LTA4HL3MBTL1LMNAPPARA
SCHEMBL3372345 0.88 FFAR1 (0.49) FFAR1LTA4HL3MBTL1LMNAPPARA
SCHEMBL6906563 0.88 FFAR1 (0.49) FFAR1LTA4HL3MBTL1LMNAPPARA
SCHEMBL3370006 0.87 FFAR1 (0.51) FFAR1LTA4HL3MBTL1LMNAPPARA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1551814-B1 CHIRALE OXAZOLE-ARYLPROPIONIC ACID DERIVATIVES AND THEIR USE AS PPAR AGONISTS HOFFMANN LA ROCHE (CH) 2008-07-23 EP disclosed
EP-1537091-A1 NOVEL 2-ARYLTHIAZOLE COMPOUNDS AS PPARALPHA AND PPARGAMMA AGONISTS F.HOFFMANN-LA ROCHE AG (CH) 2005-06-08 EP disclosed
WO-2004020420-A1 NOVEL 2-ARYLTHIAZOLE COMPOUNDS AS PPARALPHA AND PPARGAMA AGONISTS F.HOFFMANN-LA ROCHE AG (CH) 2004-03-11 WO disclosed