SCHEMBL6861869

SCHEMBL6861869

CCOC(=O)CCc1ccc2c(c1)CCC(C(=O)O)O2

nearest known ligand 0.65

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
CYP4F2 P78329 9/20 0.65
CYP4A11 Q02928 9/20 0.65
PPARG P37231 2/20 0.44
PPARA Q07869 1/20 0.44
FFAR1 O14842 1/20 0.43
HRH3 Q9Y5N1 1/20 0.40

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
SCHEMBL7490725 0.83 CYP4F2 (0.55) CYP4F2CYP4A11FFAR1HRH3
Hydrochloric Acid SCHEMBL7490717 0.82 CYP4F2 (0.54) CYP4F2CYP4A11FFAR1HRH3
SCHEMBL14457112 0.81 CYP4F2 (0.60) CYP4F2CYP4A11PPARGPPARA
SCHEMBL22070572 0.81 CYP4F2 (0.82) CYP4F2CYP4A11PPARGPPARAFFAR1
SCHEMBL20730255 0.80 CYP4F2 (0.79) CYP4F2CYP4A11PPARGPPARAFFAR1
SCHEMBL23309219 0.79 CYP4F2 (1.00) CYP4F2CYP4A11PPARGPPARA
SCHEMBL6861924 0.79 CYP4F2 (0.57) CYP4F2CYP4A11PPARGPPARA
SCHEMBL338133 0.78 CYP4F2 (0.51) CYP4F2CYP4A11
SCHEMBL433940 0.75 CYP4F2 (0.50) CYP4F2CYP4A11PPARGPPARA
SCHEMBL846867 0.74 CTSB (0.58) CYP4F2CYP4A11PPARGPPARA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6797714-B2 HYPOGLYCEMIC AGENTS; ANTIDIABETIC AGENTS; SIDE EFFECT REDUCTION BAYER PHARMACEUTICALS CORPORATION 2004-09-28 US disclosed
US-20030013705-A1 Novel carboxyl substituted chroman derivatives useful as beta 3 adrenoreceptor agonists BAYER PHARMACEUTICALS CORPORATION 2003-01-16 US disclosed
US-6469031-B1 USEFUL IN THE TREATMENT OF CONDITIONS SUCH AS HYPER-TRIGLYCERIDAEMIA, HYPERCHOLESTEROLAEMIA AND IN LOWERING HIGH DENSITY LIPOPROTEIN LEVELS AS WELL AS IN THE TREATMENT OF ATHEROSCLEROTIC, CARDIOVASCULAR AND DIABETIC CONDITIONS BAYER CORPORATION 2002-10-22 US disclosed
EP-1040106-B1 CARBOXYL SUBSTITUTED CHROMAN DERIVATIVES USEFUL AS BETA 3 ADRENORECEPTOR AGONISTS BAYER AG (US) 2002-08-28 EP disclosed
CN-1284952-A Carboxyl substituted chroman derivatives useful as beta 3 adrenoreceptor agonists BAYER AG (US) 2001-02-21 CN 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-20030013705-A1 Novel carboxyl substituted chroman derivatives useful as beta 3 adrenoreceptor agonists ADRB3, ADRB1, ADRB2 CYP4F2 1328/4885CYP4A11 301/4885PPARG 500/4885

“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.