SCHEMBL4487371

SCHEMBL4487371

CC(C)c1oc(-c2ccc(C(C)(C)C)cc2)nc1COC[C@@H]1CCCC(COC(C)(C)C(=O)O)C1

nearest known ligand 0.48

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
PPARA Q07869 12/20 0.48
PPARG P37231 11/20 0.48
PPARD Q03181 6/20 0.48
CETP P11597 1/20 0.35
IKBKB O14920 2/20 0.34
S1PR4 O95977 3/20 0.33
S1PR1 P21453 3/20 0.33
S1PR5 Q9H228 3/20 0.33
S1PR3 Q99500 1/20 0.33

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
SCHEMBL4380679 1.00 PPARA (0.48) PPARAPPARGPPARDCETPIKBKB
SCHEMBL4383609 1.00 PPARA (0.48) PPARAPPARGPPARDCETPIKBKB
SCHEMBL4481413 1.00 PPARA (0.48) PPARAPPARGPPARDCETPIKBKB
SCHEMBL4386898 0.96 PPARA (0.45) PPARAPPARGPPARDCETPIKBKB
SCHEMBL4380740 0.96 PPARA (0.45) PPARAPPARGPPARDCETPIKBKB
SCHEMBL4480680 0.93 PPARG (0.42) PPARAPPARGPPARDCETPS1PR1
SCHEMBL4380140 0.93 PPARG (0.42) PPARAPPARGPPARDCETPS1PR1
SCHEMBL4494219 0.90 PPARG (0.40) PPARAPPARGPPARDS1PR4S1PR1
SCHEMBL4377284 0.90 PPARG (0.40) PPARAPPARGPPARDS1PR4S1PR1
SCHEMBL4377242 0.90 PPARA (0.39) PPARAPPARGPPARDCETPS1PR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7538131-B2 2-{-3-′2-(phenyl)-oxazol-4-ylmethoxymethyl-cyclohexylmethoxy}-propionic acid derivatives useful as peroxisome proliferator-activated receptor (PPAR) ligands for the treatment of hyperlipidemia and diabetes SANOFI-AVENTIS DEUTSCHLAND GMBH (DE) 2009-05-26 US disclosed
US-20070197612-A1 2-{-3-'2-(PHENYL)-OXAZOL-4-YLMETHOXYMETHYL-CYCLOHEXYLMETHOXY}-PROPIONIC ACID DERIVATIVES USEFUL AS PEROXISOME PROLIFERATOR-ACTIVATED RECEPTOR (PPAR) LIGANDS FOR THE TREATMENT OF HYPERLIPIDEMIA AND DIABETES SANOFI-AVENTIS DEUTSCHLAND GMBH (DE) 2007-08-23 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 (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-20070197612-A1 2-{-3-'2-(PHENYL)-OXAZOL-4-YLMETHOXYMETHYL-CYCLOHEXYLMETHOXY}-PROPIONIC ACID DERIVATIVES USEFUL AS PEROXISOME PROLIFERATOR-ACTIVATED RECEPTOR (PPAR) LIGANDS FOR THE TREATMENT OF HYPERLIPIDEMIA AND DIABETES PPARA, PPARG, PPARD PPARA 1/4885PPARG 2/4885PPARD 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.