SCHEMBL5484146

SCHEMBL5484146

C/C(C#Cc1cccc(C(F)(F)F)c1)=C/CO

nearest known ligand 0.47

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
FFAR1 O14842 3/20 0.47
GRM5 P41594 8/20 0.45
PTPN1 P18031 1/20 0.41
PTGES O14684 2/20 0.39
PTGDR2 Q9Y5Y4 1/20 0.38
MAOB P27338 2/20 0.37
AOC3 Q16853 1/20 0.37
PPARG P37231 1/20 0.36
PPARA Q07869 1/20 0.36
FFAR4 Q5NUL3 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
SCHEMBL5632474 0.85 FFAR1 (0.52) FFAR1PPARAFFAR4
SCHEMBL5632476 0.85 FFAR1 (0.52) FFAR1PPARAFFAR4
SCHEMBL4472156 0.77 FFAR1 (0.52) FFAR1GRM5PTPN1PTGESPTGDR2
SCHEMBL5486388 0.76 FFAR1 (0.50) FFAR1PPARAFFAR4
SCHEMBL5634910 0.74 FFAR1 (0.54) FFAR1PPARAFFAR4
SCHEMBL30873473 0.74 GRM5 (0.58) FFAR1GRM5PTPN1PTGESPTGDR2
SCHEMBL1591331 0.73 FFAR1 (0.51) FFAR1GRM5PTPN1PTGESPTGDR2
SCHEMBL1590604 0.72 PTPN1 (0.57) FFAR1GRM5PTPN1PTGESPTGDR2
SCHEMBL8006286 0.71 GRM5 (0.53) FFAR1GRM5PTPN1PTGESPTGDR2
SCHEMBL2950490 0.71 FFAR1 (0.49) FFAR1GRM5PTPN1PTGESPTGDR2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7202213-B2 Combination therapy using a dual PPAR-α/PPAR-γ activator and a GLP-1 derivative for the treatment of metabolic syndrome and related diseases and disorders NOVO NORDISK A/S (DK) 2007-04-10 US disclosed
US-20030199451-A1 Combination therapy using a dual PPAR-a/PPAR-y activator and a GLP-1 derivative for the treatment of metabolic syndrome and related diseases and disorders HIGH POINT PHARMACEUTICALS, LLC 2003-10-23 US disclosed
US-6569901-B2 (E)-(S)-2-Ethoxy-3-(4-(5-phenyl-pent-2-en-4-ynyloxy)-phenyl)-propionic acid, ethyl ester for example; treating conditions mediated by Peroxisome Proliferator-Activated Receptors (PPAR); diabetes, obesity NOVO NORDISK A/S (DK) 2003-05-27 US disclosed
EP-1254102-A1 ALKYNYLSUBSTITUTED PROPIONIC ACID DERIVATIVES AND THEIR USE AGAINST DIABETES AND OBESITY Novo Nordisk A/S (DK) 2002-11-06 EP disclosed
US-20010041709-A1 New compounds, their preparation and use HIGH POINT PHARMACEUTICALS, LLC 2001-11-15 US disclosed
WO-2001055086-A1 ALKYNYLSUBSTITUTED PROPIONIC ACID DERIVATIVES AND THEIR USE AGAINST DIABETES AND OBESITY NOVO NORDISK A/S (DK) 2001-08-02 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 (2 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-20010041709-A1 New compounds, their preparation and use PPARG, PPARD, PPARA FFAR1 19/4885GRM5 615/4885PTPN1 3323/4885
US-20030199451-A1 Combination therapy using a dual PPAR-a/PPAR-y activator and a GLP-1 derivative for the treatment of metabolic syndrome and related diseases and disorders GLP1R, PPARG, PPARA FFAR1 55/4885GRM5 279/4885PTPN1 1414/4885

“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.