SCHEMBL4896575

SCHEMBL4896575

COc1ccc2cc(OCCOc3ccc(CCC(=O)O)c(C(N)C(=O)c4ccccc4)c3)ccc2c1

nearest known ligand 0.46

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.46
PPARG P37231 10/20 0.43
PPARD Q03181 10/20 0.43
PPARA Q07869 9/20 0.43
ALDH1A1 P00352 2/20 0.43
CYP1A2 P05177 1/20 0.43
HPGD P15428 1/20 0.43
CYP2C19 P33261 1/20 0.43
HSD17B10 Q99714 1/20 0.43
FFAR1 O14842 2/20 0.39
MTNR1A P48039 2/20 0.39
KDM4E B2RXH2 1/20 0.39
PTPN7 P35236 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
SCHEMBL4893176 0.86 FFAR1 (0.44) PPARGPPARDPPARAFFAR1
SCHEMBL4896557 0.83 FFAR1 (0.46) PPARGPPARDPPARAFFAR1
SCHEMBL4898431 0.83 FFAR1 (0.46) PPARGPPARDPPARAFFAR1
SCHEMBL4888362 0.83 FFAR1 (0.46) PPARGPPARDPPARAFFAR1
SCHEMBL4888269 0.83 FFAR1 (0.46) PPARGPPARDPPARAFFAR1
SCHEMBL4885490 0.82 FFAR1 (0.49) PPARGPPARDPPARAFFAR1
SCHEMBL4894775 0.82 FFAR4 (0.49) PPARAFFAR1
SCHEMBL4895044 0.78 ALDH2 (0.46) POLBPPARGPPARDPPARAALDH1A1
SCHEMBL4896578 0.76 EPHX2 (0.54) POLBPPARGPPARAHPGDMTNR1A
SCHEMBL4895448 0.76 ALDH2 (0.49) POLBALDH1A1KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20080167310-A1 MODULATORS OF PEROXISOME PROLIFERATOR ACTIVATED RECEPTORS (PPAR) GOSSETT LYNN STACY 2008-07-10 US disclosed
US-7282501-B2 Modulators of peroxisome proliferator activated receptors (PPAR) ELI LILLY AND COMPANY (US) 2007-10-16 US disclosed
US-20050075378-A1 Modulators of peroxisome proliferator activated receptors (ppar) ELI LILLY AND COMPANY 2005-04-07 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 (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-20050075378-A1 Modulators of peroxisome proliferator activated receptors (ppar) PPARG, PPARA, PPARD POLB 1408/4885PPARG 1/4885PPARD 3/4885
US-20080167310-A1 MODULATORS OF PEROXISOME PROLIFERATOR ACTIVATED RECEPTORS (PPAR) PPARG, PPARA, PPARD POLB 1408/4885PPARG 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.