SCHEMBL3275318

SCHEMBL3275318

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

nearest known ligand 0.57

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
PPARD Q03181 8/20 0.57
PPARA Q07869 3/20 0.41
PKM P14618 1/20 0.41
KMT2A Q03164 1/20 0.39
PPARG P37231 2/20 0.38
TBXAS1 P24557 1/20 0.38
PTGDR2 Q9Y5Y4 8/20 0.37
PTGDR Q13258 1/20 0.36
POLB P06746 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36

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
SCHEMBL3275321 1.00 PPARD (0.57) PPARDPPARAPKMKMT2APPARG
SCHEMBL3270613 0.97 PPARD (0.60) PPARDPPARAPKMKMT2ATBXAS1
SCHEMBL3275526 0.92 PPARD (0.53) PPARDPPARAPKMTBXAS1PTGDR2
SCHEMBL3275871 0.92 PPARD (0.53) PPARDPPARAPKMTBXAS1PTGDR2
SCHEMBL3270074 0.91 PPARD (0.59) PPARDPPARAKMT2APTGDR2POLB
SCHEMBL3270077 0.91 PPARD (0.59) PPARDPPARAKMT2APTGDR2POLB
SCHEMBL3270544 0.89 PPARD (0.72) PPARDPPARAPPARGPTGDR2POLB
SCHEMBL3270156 0.89 PPARD (0.52) PPARDPPARAPKMTBXAS1PTGDR2
SCHEMBL3274693 0.89 PPARD (0.62) PPARDPPARAKMT2ATBXAS1PTGDR2
SCHEMBL3275891 0.89 PPARD (0.62) PPARDPPARAKMT2ATBXAS1PTGDR2

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 2/4885PPARA 3/4885PKM 697/4885

“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.