SCHEMBL3270528

SCHEMBL3270528

O=C(O)COc1ccc(SC/C=C(/c2ccccc2)c2ccc(F)cc2)cc1Br

nearest known ligand 0.62

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
PPARD Q03181 9/20 0.62
PKM P14618 1/20 0.55
PTGDR2 Q9Y5Y4 4/20 0.42
PPARA Q07869 3/20 0.41
KMT2A Q03164 1/20 0.39
NPC1 O15118 1/20 0.38
MAPT P10636 1/20 0.38
RAB9A P51151 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
PPARG P37231 2/20 0.38
TBXAS1 P24557 1/20 0.38
ALDH1A1 P00352 1/20 0.38
POLB P06746 1/20 0.38
PTPN7 P35236 1/20 0.37
PTPN12 Q05209 1/20 0.37
PTPN22 Q9Y2R2 1/20 0.37

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
SCHEMBL3270530 1.00 PPARD (0.62) PPARDPKMPTGDR2PPARAKMT2A
SCHEMBL3269862 0.97 PPARD (0.66) PPARDPKMPTGDR2PPARAKMT2A
SCHEMBL3270861 0.92 PPARD (0.58) PPARDPKMPTGDR2PPARANPC1
SCHEMBL3270862 0.92 PPARD (0.58) PPARDPKMPTGDR2PPARANPC1
SCHEMBL3270355 0.91 PPARD (0.74) PPARDPKMPTGDR2PPARAPOLB
SCHEMBL3270351 0.91 PPARD (0.74) PPARDPKMPTGDR2PPARAPOLB
SCHEMBL3270542 0.89 PPARD (0.57) PPARDPKMPTGDR2PPARANPC1
SCHEMBL3270991 0.89 PPARD (0.69) PPARDPKMPTGDR2PPARAMAPT
SCHEMBL3274240 0.89 PPARD (0.69) PPARDPKMPTGDR2PPARAKMT2A
SCHEMBL3269683 0.89 PPARD (0.62) PPARDPKMPTGDR2PPARAKMT2A

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
US-20050070583-A1 Novel compounds, their preparation and use VTVX HOLDINGS II LLC 2005-03-31 US 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
EP-1558572-A2 NOVEL COMPOUNDS AND THEIR USE AS PRAR-MODULATORS NOVO NORDISK A/S (DK) 2005-08-03 EP disclosed
US-20050070583-A1 Novel compounds, their preparation and use VTVX HOLDINGS II LLC 2005-03-31 US disclosed
WO-2004037776-A2 NOVEL COMPOUNDS AND THEIR USE AS PRAR-MODULATORS NOVO NORDISK A/S (DK) 2004-05-06 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-20050070583-A1 Novel compounds, their preparation and use PPARG, PPARD, PPARA PPARD 2/4885PKM 697/4885PTGDR2 65/4885

“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.