SCHEMBL3270774

SCHEMBL3270774

O=C(O)COc1ccc(SC/C=C(/c2ccccc2)c2cccc(C(F)(F)CF)c2)cc1Br

nearest known ligand 0.52

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
PPARD Q03181 11/20 0.52
PKM P14618 1/20 0.40
PTPN1 P18031 1/20 0.38
PPARA Q07869 1/20 0.37
PTGDR2 Q9Y5Y4 6/20 0.37
TBXAS1 P24557 1/20 0.35

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
SCHEMBL3271217 0.93 PPARD (0.56) PPARDPKMPTPN1PPARAPTGDR2
SCHEMBL3270360 0.92 PPARD (0.55) PPARDPKMPTPN1PTGDR2TBXAS1
SCHEMBL3270364 0.92 PPARD (0.55) PPARDPKMPTPN1PTGDR2TBXAS1
SCHEMBL3273859 0.90 PPARD (0.54) PPARDPKMPTGDR2TBXAS1
SCHEMBL3269167 0.89 PPARD (0.62) PPARDPTPN1PPARAPTGDR2TBXAS1
SCHEMBL3274195 0.89 PPARD (0.48) PPARDPPARAPTGDR2TBXAS1
SCHEMBL3271813 0.89 PPARD (0.62) PPARDPPARA
SCHEMBL3275400 0.87 PPARD (0.44) PPARDPTPN1TBXAS1
SCHEMBL3271021 0.86 PPARD (0.59) PPARDPKMPPARAPTGDR2
SCHEMBL3274855 0.86 PPARD (0.59) PPARDPKMPPARAPTGDR2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1558572-B1 NOVEL COMPOUNDS AND THEIR USE AS PRAR-MODULATORS HIGH POINT PHARMACEUTICALS LLC (US) 2010-06-30 EP claimed
US-7129268-B2 Peroxisome proliferator activated receptor-active arylene acetic acid derivatives NOVO NORDISK A/S (DK) 2006-10-31 US claimed
EP-1558572-A2 NOVEL COMPOUNDS AND THEIR USE AS PRAR-MODULATORS NOVO NORDISK A/S (DK) 2005-08-03 EP claimed
US-20050070583-A1 Novel compounds, their preparation and use VTVX HOLDINGS II LLC 2005-03-31 US claimed
WO-2004037776-A2 NOVEL COMPOUNDS AND THEIR USE AS PRAR-MODULATORS NOVO NORDISK A/S (DK) 2004-05-06 WO claimed
EP-1558572-B1 NOVEL COMPOUNDS AND THEIR USE AS PRAR-MODULATORS HIGH POINT PHARMACEUTICALS LLC (US) 2010-06-30 EP disclosed
US-7129268-B2 Peroxisome proliferator activated receptor-active arylene acetic acid derivatives NOVO NORDISK A/S (DK) 2006-10-31 US disclosed
US-20050070583-A1 Novel compounds, their preparation and use VTVX HOLDINGS II LLC 2005-03-31 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-20050070583-A1 Novel compounds, their preparation and use PPARG, PPARD, PPARA PPARD 2/4885PKM 697/4885PTPN1 3065/4885

“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.