SCHEMBL3270110

SCHEMBL3270110

O=C(O)COc1ccc(SCC=C(c2ccc(OC(F)(F)F)cc2)c2ccc(OC(F)(F)F)cc2)cc1Cl

nearest known ligand 0.72

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
PPARD Q03181 15/20 0.72
TDP1 Q9NUW8 2/20 0.43
MRGPRX4 Q96LA9 1/20 0.43
CYP2C19 P33261 1/20 0.42
TSHR P16473 1/20 0.40
PPARA Q07869 1/20 0.40
FFAR1 O14842 1/20 0.39
FFAR4 Q5NUL3 1/20 0.39

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
SCHEMBL3271175 0.97 PPARD (0.68) PPARDTDP1MRGPRX4CYP2C19TSHR
SCHEMBL5959696 0.97 PPARD (0.68) PPARDTDP1MRGPRX4CYP2C19PPARA
SCHEMBL3271176 0.97 PPARD (0.68) PPARDTDP1MRGPRX4CYP2C19TSHR
SCHEMBL3273506 0.89 PPARD (0.63) PPARDTDP1MRGPRX4CYP2C19TSHR
SCHEMBL3273509 0.89 PPARD (0.63) PPARDTDP1MRGPRX4CYP2C19TSHR
SCHEMBL3269059 0.89 PPARD (0.63) PPARDTDP1MRGPRX4CYP2C19TSHR
SCHEMBL3275564 0.88 PPARD (0.60) PPARDPPARA
SCHEMBL3274957 0.88 PPARD (0.55) PPARDPPARA
SCHEMBL3270962 0.88 PPARD (0.72) PPARDPPARA
SCHEMBL3274480 0.88 PPARD (0.75) PPARDTDP1CYP2C19PPARA

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 10 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
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 3789/4885MRGPRX4 983/4885

“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.