SCHEMBL6701987

SCHEMBL6701987

CC(C)(Oc1ccc(O)cc1-c1ccccc1)C(=O)O

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.48
ALDH1A1 P00352 1/20 0.48
HSD17B10 Q99714 1/20 0.48
PPARG P37231 3/20 0.45
PPARA Q07869 2/20 0.45
CYP2C9 P11712 1/20 0.45
CYP2C19 P33261 1/20 0.45
PPARD Q03181 1/20 0.45
PTGDR2 Q9Y5Y4 5/20 0.44
ESR2 Q92731 2/20 0.44
ALOX5 P09917 1/20 0.43
ACLY P53396 1/20 0.43
ESR1 P03372 1/20 0.41
SLC22A12 Q96S37 1/20 0.41
PELI1 Q96FA3 1/20 0.40
BACE1 P56817 3/20 0.40
PTPN7 P35236 1/20 0.39
DUSP3 P51452 1/20 0.39
PTPN12 Q05209 1/20 0.39
PTPN22 Q9Y2R2 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
SCHEMBL3930336 0.78 KDM4E (0.45) KDM4EALDH1A1HSD17B10PPARGPPARA
SCHEMBL9513770 0.76 BACE1 (0.56) KDM4EALDH1A1HSD17B10PTGDR2ESR2
SCHEMBL3194219 0.75 BACE1 (0.54) ESR2ALOX5ESR1PELI1BACE1
SCHEMBL4037713 0.75 ALDH1A1 (0.54) KDM4EALDH1A1HSD17B10PPARGPPARA
SCHEMBL17853796 0.74 PTGDR2 (0.41) KDM4EALDH1A1HSD17B10PTGDR2ESR2
SCHEMBL18845273 0.72 GAA (0.39) KDM4EALDH1A1HSD17B10PTGDR2ESR2
SCHEMBL4037829 0.72 PTGDR2 (0.45) PPARGPPARACYP2C9CYP2C19PPARD
SCHEMBL9857403 0.72 ESR2 (0.56) ALDH1A1HSD17B10PTGDR2ESR2ALOX5
SCHEMBL29111497 0.71 PTGDR2 (0.49) KDM4EALDH1A1PTGDR2ESR2ALOX5
SCHEMBL767483 0.71 ESR1 (0.55) ALDH1A1HSD17B10PTGDR2ESR2ALOX5

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6825222-B2 2-(4-(2-(2-BIPHENYL-YL-5-METHYL-THIAZOL-4-YL)-ALKOXY)-PHENOXY) -2-METHYL-PROPIONIC ACID DERIVATIVES; ANTIDIABETIC AGENTS ELI LILLY AND COMPANY 2004-11-30 US disclosed
US-20040019090-A1 2-(4-(2-(2-biphenyl-yl-5-methyl-thiazol-4-yl)-alkoxy)-phenoxy) -2-methyl-propionic acid derivatives; antidiabetic agents ELI LILLY & COMPANY 2004-01-29 US disclosed
EP-1206457-B1 BIARYL-OXA(THIA)ZOLE DERIVATIVES AND THEIR USE AS PPARS MODULATORS LILLY CO ELI (US) 2003-10-15 EP disclosed
US-6610696-B2 Such as 2-(4-(2-(2-(4-(3,5-dimethyl-isoxazol-4-yl)-phenyl)-5-methyloxazol-4-yl) -ethyoxy)-phenoxy)-2-methylpropionic acid for treatment of diabetes (lowering serum triglycerides) ELI LILLY AND COMPANY 2003-08-26 US disclosed
US-20030045558-A1 Modulators of peroxisome proliferator activated receptors ELI LILLY & COMPANY LILY CORPORATE CENTER (US) 2003-03-06 US disclosed
WO-2001016120-A9 BIARYL-OXA(THIA)ZOLE DERIVATIVES AND THEIR USE AS PPARS MODULATORS LILLY CO ELI (US) 2002-07-11 WO disclosed
US-6417212-B1 PHENYLOXAZOLE SUBSTITUTED ON BENZENEOXYPROPIONIC ACID OR ESTERS ELI LILLY & COMPANY 2002-07-09 US disclosed
EP-1206457-A1 BIARYL-OXA(THIA)ZOLE DERIVATIVES AND THEIR USE AS PPARS MODULATORS ELI LILLY AND COMPANY (US) 2002-05-22 EP disclosed
WO-2001016120-A1 BIARYL-OXA(THIA)ZOLE DERIVATIVES AND THEIR USE AS PPARS MODULATORS ELI LILLY AND COMPANY (US) 2001-03-08 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 (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-20040019090-A1 2-(4-(2-(2-biphenyl-yl-5-methyl-thiazol-4-yl)-alkoxy)-phenoxy) -2-methyl-propionic acid derivatives; antidiabetic agents SLC5A2, SLC5A1, GLP1R KDM4E 3004/4885ALDH1A1 617/4885HSD17B10 469/4885
US-20030045558-A1 Modulators of peroxisome proliferator activated receptors PPARG, PPARA, PPARD KDM4E 4160/4885ALDH1A1 940/4885HSD17B10 150/4885

“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.