SCHEMBL5721665

SCHEMBL5721665

CCO[C@@H](Cc1ccc(OCC(=O)NC(Cc2ccc(Br)cc2)c2ccc(Cl)cc2)cc1)C(=O)O

nearest known ligand 0.53

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
PPARA Q07869 18/20 0.53
PPARG P37231 14/20 0.53
PPARD Q03181 8/20 0.53
KDM4E B2RXH2 1/20 0.48
ALDH1A1 P00352 1/20 0.48
SMN1; SMN2 Q16637 1/20 0.48
GPR34 Q9UPC5 1/20 0.46

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
SCHEMBL5721338 0.91 PPARA (0.54) PPARAPPARGPPARDKDM4EALDH1A1
SCHEMBL5721594 0.81 PPARA (0.55) PPARAPPARGPPARD
SCHEMBL3963606 0.81 PPARA (0.57) PPARAPPARGPPARD
SCHEMBL4890607 0.80 PPARA (0.59) PPARAPPARGPPARD
SCHEMBL3963103 0.80 PPARA (0.59) PPARAPPARGPPARD
SCHEMBL5721478 0.80 PPARA (0.50) PPARAPPARGPPARDALDH1A1
SCHEMBL5721963 0.80 PPARA (0.51) PPARAPPARGPPARD
SCHEMBL5294554 0.78 PPARA (0.53) PPARAPPARGPPARDALDH1A1
SCHEMBL6255825 0.75 PPARA (0.50) PPARAPPARGPPARDGPR34
Tert-Butylamine SCHEMBL6319866 0.75 PPARA (0.48) PPARAPPARGPPARDALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1675820-A2 PROPIONIC ACID DERIVATIVES USEFUL IN THE TREATMENT OF LIPID DISORDERS AstraZeneca AB (SE) 2006-07-05 EP disclosed
WO-2004113270-A2 PROPIONIC ACID DERIVATIVES USEFUL IN THE TREATMENT OF LIPID DISORDERS ASTRAZENECA AB (SE) 2004-12-29 WO disclosed