SCHEMBL3270544

SCHEMBL3270544

O=C(O)COc1ccc(SC/C=C(/c2ccccc2)c2ccc(Br)cc2)cc1I

nearest known ligand 0.72

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
PPARD Q03181 11/20 0.72
PTGDR2 Q9Y5Y4 6/20 0.47
PPARA Q07869 3/20 0.41
POLB P06746 1/20 0.40
TSHR P16473 1/20 0.40
CTDSP1 Q9GZU7 1/20 0.40
TDP1 Q9NUW8 1/20 0.40
L3MBTL1 Q9Y468 1/20 0.40
PPARG P37231 2/20 0.38

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
SCHEMBL3270547 1.00 PPARD (0.72) PPARDPTGDR2PPARAPOLBTSHR
SCHEMBL3269578 0.97 PPARD (0.76) PPARDPTGDR2PPARAPOLBTSHR
SCHEMBL3271080 0.92 PPARD (0.60) PPARDPTGDR2PPARAPOLBTSHR
SCHEMBL3271076 0.92 PPARD (0.60) PPARDPTGDR2PPARAPOLBTSHR
SCHEMBL3270074 0.91 PPARD (0.59) PPARDPTGDR2PPARAPOLBL3MBTL1
SCHEMBL3270077 0.91 PPARD (0.59) PPARDPTGDR2PPARAPOLBL3MBTL1
SCHEMBL3268498 0.89 PPARD (0.60) PPARDPTGDR2PPARAPOLBTSHR
SCHEMBL3274693 0.89 PPARD (0.62) PPARDPTGDR2PPARAPOLBTDP1
SCHEMBL3275891 0.89 PPARD (0.62) PPARDPTGDR2PPARAPOLBTDP1
SCHEMBL3275318 0.89 PPARD (0.57) PPARDPTGDR2PPARAPOLBPPARG

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 2/4885PTGDR2 65/4885PPARA 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.