SCHEMBL6234073

SCHEMBL6234073

Cc1nc(-c2ccc(C(F)(F)F)cc2)oc1COc1ccc(C(C)CC(=O)O)cc1

nearest known ligand 0.75

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
PPARD Q03181 9/20 0.75
PPARG P37231 6/20 0.75
PPARA Q07869 4/20 0.70
PTPN1 P18031 1/20 0.52
FFAR1 O14842 10/20 0.51
CHRM5 P08912 1/20 0.49
SLC6A3 Q01959 1/20 0.49
S1PR1 P21453 1/20 0.47
S1PR3 Q99500 1/20 0.47
S1PR5 Q9H228 1/20 0.47
VDR P11473 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
SCHEMBL13140202 0.86 PTPN1 (0.56) PPARDPPARGPPARAPTPN1FFAR1
SCHEMBL6236889 0.86 PPARD (1.00) PPARDPPARGPPARAPTPN1FFAR1
SCHEMBL2241876 0.85 FFAR1 (0.70) PPARDPPARGPPARAPTPN1FFAR1
SCHEMBL2241866 0.85 FFAR1 (0.70) PPARDPPARGPPARAPTPN1FFAR1
SCHEMBL6234038 0.83 PPARD (0.76) PPARDPPARGPPARAPTPN1FFAR1
SCHEMBL6236852 0.82 PPARD (1.00) PPARDPPARGPPARAPTPN1FFAR1
SCHEMBL6240763 0.82 PPARD (0.76) PPARDPPARGPPARAPTPN1FFAR1
SCHEMBL13140186 0.82 PPARG (0.68) PPARDPPARGPPARAFFAR1
Acrylic Acid SCHEMBL6260476 0.81 PPARD (0.89) PPARDPPARGPPARAPTPN1FFAR1
SCHEMBL6237550 0.80 PPARD (0.81) PPARDPPARGPPARAPTPN1FFAR1

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
EP-1189895-B8 THIAZOLE AND OXAZOLE DERIVATIVES AND THEIR PHARMACEUTICAL USE SMITHKLINE BEECHAM CORP (US) 2005-11-09 EP disclosed
EP-1189895-B1 THIAZOLE AND OXAZOLE DERIVATIVES AND THEIR PHARMACEUTICAL USE SMITHKLINE BEECHAM CORP (US) 2005-06-08 EP disclosed
US-6723740-B2 ADMINISTERING THERAPEUTIC AMOUNT OF HUMAN PEROXISOME PROLIFERATOR ACTIVATED RECEPTOR DELTA AGONIST TO LOWER TRIGLYCERIDES SMITHKLINE BEECHAM CORPORATION 2004-04-20 US disclosed
US-6710063-B1 Activators of PPAR delta SMITHKLINE BEECHAM CORPORATION 2004-03-23 US disclosed
US-20030203947-A1 Administration of a therapeutic amount of a 1,3-thiazole-5-yl methylsulfanyl or 1,3-oxazole-5-yl methylsulfanyl derivative to a patient for lowering triglycerides CHAO ESTHER YU-HSUAN (US) 2003-10-30 US disclosed
EP-1189895-A1 THIAZOLE AND OXAZOLE DERIVATIVES AND THEIR PHARMACEUTICAL USE GLAXO GROUP LIMITED (GB) 2002-03-27 EP disclosed
WO-2001000603-A1 THIAZOLE AND OXAZOLE DERIVATIVES AND THEIR PHARMACEUTICAL USE GLAXO GROUP LIMITED (GB) 2001-01-04 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-20030203947-A1 Administration of a therapeutic amount of a 1,3-thiazole-5-yl methylsulfanyl or 1,3-oxazole-5-yl methylsulfanyl derivative to a patient for lowering triglycerides PPARA, PPARD, PPARG PPARD 2/4885PPARG 3/4885PPARA 1/4885

“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.