SCHEMBL5380378

SCHEMBL5380378

CO[C@@H](Cc1ccc(C#CCOc2ccc(F)cc2)cc1)C(=O)O

nearest known ligand 0.61

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
PPARA Q07869 16/20 0.61
PPARG P37231 11/20 0.61
PPARD Q03181 11/20 0.61
EGLN1 Q9GZT9 1/20 0.43
FFAR1 O14842 1/20 0.43
ACACB O00763 1/20 0.43
HAO1 Q9UJM8 1/20 0.43

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
SCHEMBL5383421 0.94 PPARA (0.59) PPARAPPARGPPARD
SCHEMBL5379877 0.91 PPARA (0.52) PPARAPPARGPPARDEGLN1
SCHEMBL5379884 0.91 PPARA (0.52) PPARAPPARGPPARDEGLN1
SCHEMBL5375703 0.87 PPARG (0.70) PPARAPPARGPPARD
SCHEMBL5375792 0.87 PPARA (0.80) PPARAPPARGPPARDFFAR1ACACB
SCHEMBL5392011 0.87 PPARG (0.70) PPARAPPARGPPARD
SCHEMBL5385194 0.87 PPARA (0.66) PPARAPPARGPPARD
SCHEMBL5375797 0.87 PPARA (0.80) PPARAPPARGPPARDFFAR1ACACB
SCHEMBL5381510 0.85 PPARA (0.60) PPARAPPARGPPARDFFAR1ACACB
SCHEMBL5382121 0.85 PPARA (0.71) PPARAPPARGPPARDACACB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20070276138-A1 Modulators of peroxisome proliferator activated receptors BROOKS DAWN A 2007-11-29 US disclosed
US-20070276138-A1 Modulators of peroxisome proliferator activated receptors BROOKS DAWN A 2007-11-29 US disclosed
US-7192982-B2 Modulators of peroxisome proliferator activated receptors LIGAND PHARMACEUTICALS, INC. (US) 2007-03-20 US disclosed
US-7192982-B2 Modulators of peroxisome proliferator activated receptors LIGAND PHARMACEUTICALS, INC. (US) 2007-03-20 US disclosed
US-20050020684-A1 Modulators of peroxisome proliferator activated receptors ELI LILLY AND COMPANY 2005-01-27 US disclosed
EP-1392637-A2 MODULATORS OF PEROXISOME PROLIFERATOR ACTIVATED RECEPTORS ELI LILLY AND COMPANY (US) 2004-03-03 EP disclosed
WO-2002100813-A2 MODULATORS OF PEROXISOME PROLIFERATOR ACTIVATED RECEPTORS ELI LILLY AND COMPANY (US) 2002-12-19 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 (2 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-20050020684-A1 Modulators of peroxisome proliferator activated receptors NCOA4, PPARG, PPARA PPARA 3/4885PPARG 2/4885PPARD 7/4885
US-20070276138-A1 Modulators of peroxisome proliferator activated receptors PPARG, NCOA4, PPARA PPARA 3/4885PPARG 1/4885PPARD 4/4885

“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.