SCHEMBL6747533

SCHEMBL6747533

CCCCCCCN(CCc1ccc(CC(OCC)C(=O)O)cc1)C(=O)Nc1ccc(F)cc1F

nearest known ligand 0.66

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
PPARG P37231 4/20 0.66
PPARA Q07869 4/20 0.66
PPARD Q03181 2/20 0.64
SOAT1 P35610 3/20 0.56
SOAT2 O75908 2/20 0.50

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
SCHEMBL6359084 0.92 PPARG (0.59) PPARGPPARAPPARDSOAT1SOAT2
SCHEMBL6746445 0.92 PPARG (0.63) PPARGPPARAPPARDSOAT1SOAT2
SCHEMBL6750140 0.92 PPARG (0.62) PPARGPPARAPPARDSOAT1SOAT2
SCHEMBL6746456 0.91 PPARG (0.62) PPARGPPARAPPARDSOAT1SOAT2
SCHEMBL5981461 0.90 PPARG (0.58) PPARGPPARAPPARDSOAT1SOAT2
SCHEMBL5975706 0.90 PPARG (0.58) PPARGPPARAPPARDSOAT1SOAT2
SCHEMBL5980637 0.90 PPARG (0.58) PPARGPPARAPPARDSOAT1SOAT2
SCHEMBL5980799 0.90 PPARG (0.58) PPARGPPARAPPARDSOAT1SOAT2
SCHEMBL5976313 0.90 PPARG (0.58) PPARGPPARAPPARDSOAT1SOAT2
SCHEMBL5976995 0.89 PPARA (0.57) PPARGPPARAPPARDSOAT1SOAT2

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-6699904-B2 PEROXISOME PROLIFERATOR ACTIVATOR RECEPTOR (PPAR) AGONISTS; ATHEROSCLEROSIS AND CARDIOVASCULAR DISORDERS; FOR EXAMPLE, 3-(4-(2-(3-(2,4-DIMETHOXY-PHENYL)-1-HEPTYL-UREIDO)-ETHYL)-PHENYL)-2-ETHOXY -PROPIONIC ACID PFIZER INC. 2004-03-02 US disclosed
US-20020165282-A1 Peroxisome proliferator activator receptor (PPAR) agonists; atherosclerosis and cardiovascular disorders; for example, 3-(4-(2-(3-(2,4-dimethoxy-phenyl)-1-heptyl-ureido)-ethyl)-phenyl)-2-ethoxy -propionic acid HAYWARD CHERYL M (US) 2002-11-07 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-20020165282-A1 Peroxisome proliferator activator receptor (PPAR) agonists; atherosclerosis and cardiovascular disorders; for example, 3-(4-(2-(3-(2,4-dimethoxy-phenyl)-1-heptyl-ureido)-ethyl)-phenyl)-2-ethoxy -propionic acid PPARA, PPARG, PPARD PPARG 2/4885PPARA 1/4885PPARD 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.