SCHEMBL1746632

SCHEMBL1746632

Cc1cc(OCC=C(c2ccc(C#CCN3CCC(O)CC3)cc2)c2cccc(C(F)(F)F)c2)ccc1OC(C)C(=O)O

nearest known ligand 0.41

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
PPARD Q03181 10/20 0.41
PPARG P37231 4/20 0.36
PPARA Q07869 4/20 0.36
KMT2A Q03164 1/20 0.34
PTGDR2 Q9Y5Y4 3/20 0.34
PRKD3 O94806 1/20 0.34
S1PR1 P21453 1/20 0.34
CDK7 P50613 1/20 0.34
JAK3 P52333 1/20 0.34
TNK2 Q07912 1/20 0.34
S1PR5 Q9H228 1/20 0.34

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
SCHEMBL1746630 1.00 PPARD (0.41) PPARDPPARGPPARAKMT2APTGDR2
SCHEMBL1747631 0.94 PPARD (0.47) PPARDPPARGPPARAPTGDR2
SCHEMBL1747630 0.94 PPARD (0.47) PPARDPPARGPPARAPTGDR2
SCHEMBL1746433 0.91 PPARD (0.45) PPARDPPARGPPARAPTGDR2
SCHEMBL1746438 0.91 PPARD (0.45) PPARDPPARGPPARAPTGDR2
SCHEMBL1743673 0.91 PPARD (0.51) PPARDPPARGPPARA
SCHEMBL1743677 0.91 PPARD (0.51) PPARDPPARGPPARA
SCHEMBL1744416 0.89 PPARD (0.40) PPARDPPARGPPARAKMT2A
SCHEMBL1747350 0.88 PPARD (0.38) PPARDPPARGPPARA
SCHEMBL1745277 0.88 TSHR (0.41) PPARDPPARGPPARAPTGDR2

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.