SCHEMBL4458527

SCHEMBL4458527

OCCOc1ccc(OC(F)(F)F)cc1Cl

nearest known ligand 0.53

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
PPARA Q07869 9/20 0.53
PPARD Q03181 5/20 0.53
FFAR4 Q5NUL3 8/20 0.52
FFAR1 O14842 4/20 0.52
SCN5A Q14524 2/20 0.52
CYP2C9 P11712 1/20 0.52
MRGPRX4 Q96LA9 1/20 0.52
PPARG P37231 3/20 0.47
MCHR1 Q99705 1/20 0.45
CYP3A4 P08684 1/20 0.44
KCNH2 Q12809 1/20 0.44
CACNA1C Q13936 1/20 0.44

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
SCHEMBL3143308 0.92 PPARA (0.55) PPARAPPARDFFAR4FFAR1SCN5A
SCHEMBL2091249 0.87 MRGPRX4 (0.54) PPARAPPARDFFAR4FFAR1SCN5A
SCHEMBL10800881 0.84 PPARA (0.50) PPARAPPARDFFAR4FFAR1SCN5A
SCHEMBL22809496 0.84 PPARA (0.50) PPARAPPARDFFAR4FFAR1SCN5A
SCHEMBL4465407 0.84 PPARA (0.50) PPARAPPARDFFAR4FFAR1SCN5A
SCHEMBL13545909 0.84 PPARA (0.59) PPARAPPARDFFAR4FFAR1SCN5A
SCHEMBL9503538 0.83 SMN1; SMN2 (0.50) PPARAPPARDFFAR4FFAR1PPARG
Hydrochloric Acid SCHEMBL20595190 0.83 PPARA (0.49) PPARAPPARDFFAR4FFAR1SCN5A
SCHEMBL4463869 0.83 PPARA (0.52) PPARAPPARDFFAR4FFAR1SCN5A
SCHEMBL10801456 0.83 PPARA (0.52) PPARAPPARDFFAR4FFAR1SCN5A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7524882-B2 PPAR alpha selective compounds for the treatment of dyslipidemia and other lipid disorders MERCK & CO., INC. (US) 2009-04-28 US disclosed
EP-1539136-B1 PPAR ALPHA SELECTIVE COMPOUNDS FOR THE TREATMENT OF DYSLIPIDEMIA AND OTHER LIPID DISORDERS MERCK & CO INC (US) 2008-07-09 EP disclosed
EP-1539136-A4 PPAR ALPHA SELECTIVE COMPOUNDS FOR THE TREATMENT OF DYSLIPIDEMIA AND OTHER LIPID DISORDERS MERCK & CO INC (US) 2006-10-18 EP disclosed
US-20050228044-A1 Ppar alpha selective compounds for the treatment of dyslipidemia and other lipid disorders MERCK SHARP & DOHME CORP. 2005-10-13 US disclosed
EP-1539136-A2 PPAR ALPHA SELECTIVE COMPOUNDS FOR THE TREATMENT OF DYSLIPIDEMIA AND OTHER LIPID DISORDERS Merck & Co., Inc. (US) 2005-06-15 EP disclosed
WO-2004010936-A2 PPAR ALPHA SELECTIVE COMPOUNDS FOR THE TREATMENT OF DYSLIPIDEMIA AND OTHER LIPID DISORDERS MERCK & CO., INC. (US) 2004-02-05 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20050228044-A1 Ppar alpha selective compounds for the treatment of dyslipidemia and other lipid disorders PPARD, PPARA, PPARG PPARA 2/4885PPARD 1/4885FFAR4 23/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.