SCHEMBL4575229

SCHEMBL4575229

CC(C)(Oc1ccc(CCNCc2ccc(C(F)(F)F)cc2)cc1)C(=O)O

nearest known ligand 0.61

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
PPARA Q07869 16/20 0.61
PPARD Q03181 11/20 0.61
ADRB3 P13945 3/20 0.57
PPARG P37231 7/20 0.55
ALDH1A1 P00352 1/20 0.55
FABP2 P12104 1/20 0.55
SMN1; SMN2 Q16637 1/20 0.55

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
SCHEMBL6638762 0.90 ADRB3 (0.59) PPARAPPARDADRB3PPARGALDH1A1
SCHEMBL4576063 0.89 PPARA (0.50) PPARAPPARDADRB3PPARGALDH1A1
SCHEMBL6407513 0.88 KDM4E (0.64) PPARAPPARDADRB3PPARGALDH1A1
SCHEMBL4575333 0.87 PPARA (0.48) PPARAPPARDADRB3PPARGALDH1A1
SCHEMBL4575310 0.86 PPARA (0.50) PPARAPPARDADRB3PPARGALDH1A1
SCHEMBL5436500 0.83 PPARA (0.60) PPARAPPARDPPARG
SCHEMBL3371243 0.81 PPARA (0.64) PPARAPPARDPPARGALDH1A1FABP2
SCHEMBL4575114 0.81 PPARA (0.58) PPARAPPARDPPARG
SCHEMBL3848024 0.80 ADRB3 (0.73) PPARAPPARDADRB3PPARGALDH1A1
SCHEMBL4615722 0.79 MAPK14 (0.74) PPARAPPARDPPARGALDH1A1FABP2

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-7319104-B2 hPPARs activators SMITHKLINE BEECHAM CORPORATION (US) 2008-01-15 US disclosed
US-20050137212-A1 Hppars activators SMITHKLINE BEECHAM CORPORATION 2005-06-23 US disclosed
EP-1480957-A1 HPPARS ACTIVATORS SMITHKLINE BEECHAM CORPORATION (US) 2004-12-01 EP disclosed
EP-1449835-A2 Alpha-substituted pyrimidine-thioalkyl and alkylether compounds PHARMACIA & UPJOHN COMPANY (US) 2004-08-25 EP disclosed
WO-2003074495-A1 HPPARS ACTIVATORS SMITHKLINE BEECHAM CORPORATION (US) 2003-09-12 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-20050137212-A1 Hppars activators PPARG, PPARA, PPARD PPARA 2/4885PPARD 3/4885ADRB3 29/4885

“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.