SCHEMBL6234716

SCHEMBL6234716

Cc1nc(-c2ccc(C(F)(F)F)cc2)oc1CSc1ccc(CC(=O)O)cc1

nearest known ligand 0.74

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
PPARD Q03181 14/20 0.74
PPARG P37231 8/20 0.74
PPARA Q07869 9/20 0.67
PTGDR2 Q9Y5Y4 1/20 0.50
TP53 P04637 1/20 0.44
MAPT P10636 1/20 0.44
PTPN1 P18031 1/20 0.43
PSEN1 P49768 1/20 0.43
PSEN2 P49810 1/20 0.43
APH1B Q8WW43 1/20 0.43
NCSTN Q92542 1/20 0.43
APH1A Q96BI3 1/20 0.43
PSENEN Q9NZ42 1/20 0.43
VDR P11473 1/20 0.43
RXRA P19793 1/20 0.43
RXRB P28702 1/20 0.43
RXRG P48443 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
SCHEMBL6238448 0.89 PPARD (0.76) PPARDPPARGPPARAPTGDR2TP53
SCHEMBL6237881 0.89 PPARD (0.67) PPARDPPARGPPARAPTGDR2TP53
SCHEMBL6238041 0.85 PPARD (1.00) PPARDPPARGPPARAPTPN1
SCHEMBL6234817 0.84 PPARD (0.63) PPARDPPARGPPARAPTGDR2PTPN1
SCHEMBL6263990 0.83 PPARD (0.65) PPARDPPARGPPARAVDR
SCHEMBL3804094 0.83 PPARD (0.66) PPARDPPARGPPARAPTPN1PSEN1
SCHEMBL3819065 0.81 PPARD (1.00) PPARDPPARGPPARA
SCHEMBL6265961 0.80 PPARD (0.70) PPARDPPARGPPARAMAPT
SCHEMBL6237599 0.79 PPARD (0.82) PPARDPPARGPPARATP53MAPT
SCHEMBL6235596 0.78 PPARD (0.72) PPARDPPARGPPARAPTGDR2MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1189895-B1 THIAZOLE AND OXAZOLE DERIVATIVES AND THEIR PHARMACEUTICAL USE SMITHKLINE BEECHAM CORP (US) 2005-06-08 EP claimed
US-6710063-B1 Activators of PPAR delta SMITHKLINE BEECHAM CORPORATION 2004-03-23 US claimed
US-10426757-B2 Compositions and methods for promoting intestinal stem cell and/or non-stem progenitor cell function WHITEHEAD INSTITUTE FOR BIOMEDICAL RESEARCH (US) 2019-10-01 US disclosed
US-20170258772-A1 COMPOSITIONS AND METHODS FOR PROMOTING INTESTINAL STEM CELL AND/OR NON-STEM PROGENITOR CELL FUNCTION HOWARD HUGHES MEDICAL INSTITUTE 2017-09-14 US disclosed
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 (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-10426757-B2 Compositions and methods for promoting intestinal stem cell and/or non-stem progenitor cell function FABP2, ALPG, ALPI PPARD 2842/4885PPARG 786/4885PPARA 1257/4885
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
US-20170258772-A1 COMPOSITIONS AND METHODS FOR PROMOTING INTESTINAL STEM CELL AND/OR NON-STEM PROGENITOR CELL FUNCTION FABP2, ALPG, ALPI PPARD 2842/4885PPARG 786/4885PPARA 1257/4885

“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.