SCHEMBL1746433

SCHEMBL1746433

Cc1cc(OC/C=C(\c2ccc(C#CCN3CCOCC3)cc2)c2cccc(C(F)(F)F)c2)ccc1OC(C)C(=O)O

nearest known ligand 0.45

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
PPARD Q03181 5/20 0.45
PPARG P37231 1/20 0.45
PPARA Q07869 1/20 0.45
KEAP1 Q14145 1/20 0.39
NFE2L2 Q16236 1/20 0.39
TRPV4 Q9HBA0 1/20 0.36
HTR2A P28223 1/20 0.35
KCNH2 Q12809 1/20 0.35
RAF1 P04049 3/20 0.35
BRAF P15056 3/20 0.35
EPHX2 P34913 2/20 0.35
PTGDR2 Q9Y5Y4 1/20 0.35
SLC6A4 P31645 1/20 0.35
HRH3 Q9Y5N1 1/20 0.35
MMP2 P08253 1/20 0.35
MMP3 P08254 1/20 0.35
MMP13 P45452 1/20 0.35

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
SCHEMBL1746438 1.00 PPARD (0.45) PPARDPPARGPPARAKEAP1NFE2L2
SCHEMBL1744475 0.94 PPARD (0.51) PPARDPPARGPPARAKEAP1NFE2L2
SCHEMBL1744479 0.94 PPARD (0.51) PPARDPPARGPPARAKEAP1NFE2L2
SCHEMBL1746555 0.94 PPARD (0.51) PPARDPPARGPPARAKEAP1NFE2L2
SCHEMBL1746386 0.92 PPARD (0.47) PPARDPPARGPPARAMMP2MMP3
SCHEMBL1746383 0.92 PPARD (0.47) PPARDPPARGPPARAMMP2MMP3
SCHEMBL1746387 0.92 PPARD (0.47) PPARDPPARGPPARAMMP2MMP3
SCHEMBL1746630 0.91 PPARD (0.41) PPARDPPARGPPARAPTGDR2
SCHEMBL1746632 0.91 PPARD (0.41) PPARDPPARGPPARAPTGDR2
SCHEMBL1746350 0.91 PPARD (0.54) PPARDPPARGPPARAKEAP1NFE2L2

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2386540-A1 Novel compounds, their preparation and use High Point Pharmaceuticals, LLC (US) 2011-11-16 EP disclosed
US-20110245244-A1 PHENOXY ACETIC ACIDS AS PPAR DELTA ACTIVATORS HIGH POINT PHARMACEUTICALS, LLC (US) 2011-10-06 US disclosed
US-7943613-B2 Compounds, their preparation and use HIGH POINT PHARMACEUTICALS, LLC (US) 2011-05-17 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-20110245244-A1 PHENOXY ACETIC ACIDS AS PPAR DELTA ACTIVATORS PPARG, PPARA, PPARD PPARD 3/4885PPARG 1/4885PPARA 2/4885

“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.