SCHEMBL5400441

SCHEMBL5400441

CC(C)OC(Cc1ccc(OCc2ccccc2)cc1)C(=O)O

nearest known ligand 0.71

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
PPARA Q07869 17/20 0.71
PPARG P37231 16/20 0.71
PPARD Q03181 9/20 0.67
MAOB P27338 1/20 0.57
FFAR1 O14842 1/20 0.55
FFAR4 Q5NUL3 1/20 0.55

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
SCHEMBL5400438 1.00 PPARA (0.71) PPARAPPARGPPARDMAOBFFAR1
SCHEMBL24328238 0.87 SRR (0.62) PPARAPPARG
SCHEMBL8023124 0.87 SRR (0.62) PPARAPPARG
SCHEMBL5606931 0.86 PPARA (0.74) PPARAPPARGPPARDMAOBFFAR1
SCHEMBL13819711 0.85 PPARG (0.57) PPARAPPARGPPARDFFAR1FFAR4
Rubidium SCHEMBL5607457 0.84 PPARA (0.72) PPARAPPARGPPARDMAOBFFAR1
SCHEMBL5606264 0.84 PPARA (0.72) PPARAPPARGPPARDMAOBFFAR1
SCHEMBL5607112 0.84 PPARA (0.72) PPARAPPARGPPARDMAOBFFAR1
SCHEMBL5606732 0.84 PPARA (0.72) PPARAPPARGPPARDMAOBFFAR1
Ammonia Solution, Strong SCHEMBL5606255 0.84 PPARA (0.72) PPARAPPARGPPARDMAOBFFAR1

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-20070142472-A1 Process for producing optically active 3-(4-hydroxyphenyl)proprionic acids TAKASAGO INTERNATIONAL CORPORATION (JP) 2007-06-21 US disclosed
US-7192982-B2 Modulators of peroxisome proliferator activated receptors LIGAND PHARMACEUTICALS, INC. (US) 2007-03-20 US disclosed
EP-1687250-A1 PROCESS FOR PRODUCING OPTICALLY ACTIVE 3-(4-HYDROXYPHENYL)PROPIONIC ACIDS Takasago International Corporation (JP) 2006-08-09 EP disclosed
WO-2005051882-A1 PROCESS FOR PRODUCING OPTICALLY ACTIVE 3-(4-HYDROXYPHENYL)PROPIONIC ACIDS TAKASAGO INTERNATIONAL CORPORATION (JP) 2005-06-09 WO disclosed
US-20050020684-A1 Modulators of peroxisome proliferator activated receptors ELI LILLY AND COMPANY 2005-01-27 US disclosed
CN-1543451-A Receptor modulators activated by peroxizonal proliferators (ppar) 2004-11-03 CN 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 (3 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-20070142472-A1 Process for producing optically active 3-(4-hydroxyphenyl)proprionic acids ALDH1A2, ALDH1A3, GRHPR PPARA 472/4885PPARG 1052/4885PPARD 783/4885
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.