SCHEMBL6239392

SCHEMBL6239392

COC(=O)CSc1ccc(OCc2oc(-c3ccc(C(F)(F)F)cc3)nc2C)cc1

nearest known ligand 0.68

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
PPARD Q03181 15/20 0.68
PPARG P37231 8/20 0.68
PPARA Q07869 7/20 0.64
VDR P11473 9/20 0.49
ESR1 P03372 3/20 0.49
THRA P10827 3/20 0.49
THRB P10828 3/20 0.49
RXRA P19793 3/20 0.49
ESR2 Q92731 3/20 0.49
PTPN1 P18031 1/20 0.46
FFAR1 O14842 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
SCHEMBL6240763 0.90 PPARD (0.76) PPARDPPARGPPARAVDRESR1
SCHEMBL6237550 0.87 PPARD (0.81) PPARDPPARGPPARAVDRESR1
SCHEMBL6237599 0.85 PPARD (0.82) PPARDPPARGPPARAVDRESR1
SCHEMBL6236889 0.81 PPARD (1.00) PPARDPPARGPPARAVDRPTPN1
SCHEMBL6240464 0.79 PPARD (0.65) PPARDPPARGPPARAVDRESR1
SCHEMBL6238041 0.79 PPARD (1.00) PPARDPPARGPPARAPTPN1FFAR1
SCHEMBL6237881 0.79 PPARD (0.67) PPARDPPARGPPARAVDRESR1
SCHEMBL6234038 0.78 PPARD (0.76) PPARDPPARGPPARAVDRPTPN1
SCHEMBL6236852 0.78 PPARD (1.00) PPARDPPARGPPARAVDRPTPN1
SCHEMBL6238448 0.77 PPARD (0.76) PPARDPPARGPPARAPTPN1

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.