SCHEMBL5407899

SCHEMBL5407899

COC(=O)C(Cc1ccc(OCCOc2ccc3c(c2)C(C)(C)CCC3(C)C)cc1)C(=O)OC

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
PPARG P37231 14/20 1.00
PPARD Q03181 8/20 0.67
PPARA Q07869 7/20 0.67
CYP3A4 P08684 5/20 0.47
CYP26A1 O43174 4/20 0.44
CYP26B1 Q9NR63 2/20 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
SCHEMBL5414800 0.95 PPARG (1.00) PPARGPPARDPPARACYP3A4CYP26A1
SCHEMBL5406320 0.93 PPARG (1.00) PPARGPPARDPPARACYP3A4CYP26A1
SCHEMBL5404293 0.89 PPARG (1.00) PPARGPPARDPPARACYP3A4CYP26A1
SCHEMBL5654555 0.85 PPARG (0.86) PPARGPPARDPPARACYP3A4CYP26A1
SCHEMBL5410702 0.81 PPARG (1.00) PPARGPPARDPPARA
SCHEMBL6704879 0.79 PPARG (0.71) PPARGPPARDPPARA
SCHEMBL5407544 0.78 PPARG (1.00) PPARGPPARDPPARA
SCHEMBL6382746 0.76 PPARG (0.67) PPARGPPARDPPARA
SCHEMBL20395690 0.76 PPARG (0.67) PPARGPPARDPPARA
SCHEMBL28512690 0.76 PPARG (0.67) PPARGPPARDPPARA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20070142427-A1 Noncyclic 1,3-Dicarbonyl compounds as dual PPAR agonists with potent antihyperglycemic and antihyperlipidemic activity SHENZHEN CHIPSCREEN BIOSCIENCES LTD. (CN) 2007-06-21 US disclosed
US-20070142427-A1 Noncyclic 1,3-Dicarbonyl compounds as dual PPAR agonists with potent antihyperglycemic and antihyperlipidemic activity SHENZHEN CHIPSCREEN BIOSCIENCES LTD. (CN) 2007-06-21 US disclosed
US-20070142427-A1 Noncyclic 1,3-Dicarbonyl compounds as dual PPAR agonists with potent antihyperglycemic and antihyperlipidemic activity SHENZHEN CHIPSCREEN BIOSCIENCES LTD. (CN) 2007-06-21 US disclosed
US-7192970-B2 Noncyclic 1,3-dicarbonyl compounds as dual PPAR agonists with potent antihyperglycemic and antihyperlipidemic activity CHIPSCREEN BIOSCIENCES, LTD. (CN) 2007-03-20 US disclosed
US-7192970-B2 Noncyclic 1,3-dicarbonyl compounds as dual PPAR agonists with potent antihyperglycemic and antihyperlipidemic activity CHIPSCREEN BIOSCIENCES, LTD. (CN) 2007-03-20 US disclosed
US-7192970-B2 Noncyclic 1,3-dicarbonyl compounds as dual PPAR agonists with potent antihyperglycemic and antihyperlipidemic activity CHIPSCREEN BIOSCIENCES, LTD. (CN) 2007-03-20 US disclosed
US-20040138211-A1 Noncyclic 1,3-dicarbonyl compounds as dual PPAR agonists with potent antihyperglycemic and antihyperlipidemic activity SHENZHEN CHIPSCREEN BIOSCIENCES LTD. (CN) 2004-07-15 US disclosed
WO-2004048338-A1 NONCYCLIC 1,3-DICARBONYL COMPOUNDS AS DUAL PPAR AGONISTS WITH POTENT ANTIHYPERGLYCEMIC AND ANTIHYPERLIPIDEMIC ACTIVITY SHENZHEN CHIPSCREEN BIOSCIENCES LTD. (US) 2004-06-10 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-20070142427-A1 Noncyclic 1,3-Dicarbonyl compounds as dual PPAR agonists with potent antihyperglycemic and antihyperlipidemic activity GPR119, PPARG, PPARA PPARG 2/4885PPARD 4/4885PPARA 3/4885
US-20040138211-A1 Noncyclic 1,3-dicarbonyl compounds as dual PPAR agonists with potent antihyperglycemic and antihyperlipidemic activity PPARG, GPR119, PPARA PPARG 1/4885PPARD 5/4885PPARA 3/4885

“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.