SCHEMBL3270576

SCHEMBL3270576

O=C(O)COc1ccc(SC/C=C(/c2ccccc2)c2cccc(Cl)c2)cc1Cl

nearest known ligand 0.72

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
PPARD Q03181 8/20 0.72
TDP1 Q9NUW8 2/20 0.51
TSHR P16473 1/20 0.47
PTGDR2 Q9Y5Y4 5/20 0.44
CYP2C9 P11712 1/20 0.42
PPARA Q07869 1/20 0.41
CYP2C19 P33261 1/20 0.41
MRGPRX4 Q96LA9 1/20 0.41
PPARG P37231 2/20 0.40
FFAR1 O14842 1/20 0.40
MAPT P10636 1/20 0.40

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
SCHEMBL3271335 1.00 PPARD (0.72) PPARDTDP1TSHRPTGDR2CYP2C9
SCHEMBL3270949 0.98 PPARD (0.71) PPARDTDP1TSHRPTGDR2CYP2C9
SCHEMBL3269925 0.91 PPARD (0.78) PPARDTDP1TSHRPTGDR2PPARA
SCHEMBL3276628 0.91 PPARD (0.78) PPARDTDP1TSHRPTGDR2PPARA
SCHEMBL3271323 0.90 PPARD (0.69) PPARDTDP1TSHRPTGDR2PPARA
SCHEMBL3270448 0.90 PPARD (0.63) PPARDTDP1PTGDR2CYP2C9PPARA
SCHEMBL3271321 0.90 PPARD (0.69) PPARDTDP1TSHRPTGDR2PPARA
SCHEMBL3269837 0.90 PPARD (0.69) PPARDTDP1TSHRPTGDR2PPARA
SCHEMBL3269832 0.90 PPARD (0.69) PPARDTDP1TSHRPTGDR2PPARA
SCHEMBL3269680 0.90 PPARD (0.58) PPARDTDP1TSHRPTGDR2CYP2C9

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 2/4885TDP1 3789/4885TSHR 1081/4885

“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.