SCHEMBL6234817

SCHEMBL6234817

Cc1nc(-c2ccc(C(F)(F)F)cc2)oc1CSc1ccc(CC(=O)O)cc1Cl

nearest known ligand 0.63

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
PPARD Q03181 14/20 0.63
PPARG P37231 7/20 0.57
PPARA Q07869 6/20 0.56
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
PTPN1 P18031 2/20 0.42
THRB P10828 1/20 0.41
NR1H2 P55055 1/20 0.41
NR1H3 Q13133 1/20 0.41
PTGDR2 Q9Y5Y4 1/20 0.40
VDR P11473 1/20 0.39
HPSE Q9Y251 1/20 0.39

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
SCHEMBL27554802 0.91 PPARD (0.61) PPARDPPARGPPARAPTPN1VDR
SCHEMBL6241083 0.90 PPARD (0.52) PPARDPPARGPPARAPTPN1THRB
SCHEMBL6234716 0.84 PPARD (0.74) PPARDPPARGPPARAPSEN1PSEN2
SCHEMBL6266388 0.82 PPARD (0.56) PPARDPPARGPPARA
SCHEMBL6237180 0.81 PPARD (0.63) PPARDPPARGPPARAPTPN1NR1H2
SCHEMBL3809452 0.80 PPARD (0.64) PPARDPPARGPPARA
SCHEMBL3804094 0.78 PPARD (0.66) PPARDPPARGPPARAPSEN1PSEN2
SCHEMBL13292330 0.78 PPARD (1.00) PPARDPPARGPPARAPSEN1PSEN2
SCHEMBL13292422 0.78 PPARD (0.90) PPARDPPARGPPARAPSEN1PSEN2
SCHEMBL6238448 0.76 PPARD (0.76) PPARDPPARGPPARAPTPN1PTGDR2

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-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
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

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-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

“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.