SCHEMBL5017401

SCHEMBL5017401

CCOC(Cc1ccc(OCc2nc(-c3ccc(OC(C)C)cc3)oc2C)cc1Cl)C(=O)OC

nearest known ligand 0.50

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.50
PPARA Q07869 15/20 0.47
PPARG P37231 14/20 0.47
MAPT P10636 3/20 0.43
THRB P10828 1/20 0.43
PPARD Q03181 1/20 0.43
TP53 P04637 1/20 0.43

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
SCHEMBL5017399 1.00 POLB (0.50) POLBPPARAPPARGMAPTTHRB
SCHEMBL5017374 0.92 POLB (0.51) POLBPPARAPPARGMAPTPPARD
SCHEMBL5015946 0.92 POLB (0.51) POLBPPARAPPARGMAPTPPARD
SCHEMBL5017372 0.92 POLB (0.51) POLBPPARAPPARGMAPTPPARD
SCHEMBL5017687 0.92 PPARA (0.55) POLBPPARAPPARGPPARD
SCHEMBL5015949 0.92 POLB (0.51) POLBPPARAPPARGMAPTPPARD
SCHEMBL5017686 0.92 PPARA (0.55) POLBPPARAPPARGPPARD
SCHEMBL5017999 0.91 PPARG (0.53) PPARAPPARGPPARD
SCHEMBL5017997 0.91 PPARG (0.53) PPARAPPARGPPARD
SCHEMBL5017329 0.90 POLB (0.50) POLBPPARAPPARGMAPTPPARD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1551814-B1 CHIRALE OXAZOLE-ARYLPROPIONIC ACID DERIVATIVES AND THEIR USE AS PPAR AGONISTS HOFFMANN LA ROCHE (CH) 2008-07-23 EP disclosed
US-7348349-B2 Oxazole derivatives HOFFMANN-LA ROCHE INC. (US) 2008-03-25 US disclosed
US-20050267180-A1 Novel oxazole derivatives BINGGELI ALFRED 2005-12-01 US disclosed
US-6969725-B2 Oxazole derivatives HOFFMAN-LA ROCHE INC. (US) 2005-11-29 US disclosed
EP-1551814-A1 CHIRALE OXAZOLE-ARYLPROPIONIC ACID DERIVATIVES AND THEIR USE AS PPAR AGONISTS F. HOFFMANN-LA ROCHE AG (CH) 2005-07-13 EP disclosed
US-20040116487-A1 Novel oxazole derivatives HOFFMANN-LA ROCHE INC. 2004-06-17 US disclosed
WO-2004031162-A1 CHIRALE OXAZOLE-ARYLPROPIONIC ACID DERIVATIVES AND THEIR USE AS PPAR AGONISTS F. HOFFMANN-LA ROCHE AG (CH) 2004-04-15 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 (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-20050267180-A1 Novel oxazole derivatives NR1H3, NR1H2, PPARD POLB 3602/4885PPARA 6/4885PPARG 7/4885

“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.