SCHEMBL5580503

SCHEMBL5580503

Cc1sc(N2CCCCC2)nc1CCOc1cccc(-c2ccccc2CC(=O)O)c1

nearest known ligand 0.44

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
PPARG P37231 17/20 0.44
PPARA Q07869 16/20 0.44
BACE1 P56817 1/20 0.44
PTGDR2 Q9Y5Y4 1/20 0.41
KDM4E B2RXH2 1/20 0.40
ALDH1A1 P00352 1/20 0.40
GAA P10253 1/20 0.40
MAPT P10636 1/20 0.40
HPGD P15428 1/20 0.40
MAPK1 P28482 1/20 0.40
NPSR1 Q6W5P4 1/20 0.40
L3MBTL1 Q9Y468 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
SCHEMBL5580696 0.92 PPARG (0.50) PPARGPPARAPTGDR2
SCHEMBL5584093 0.92 PPARG (0.44) PPARGPPARAPTGDR2
Hydrochloric Acid SCHEMBL5590776 0.91 PPARG (0.53) PPARGPPARAPTGDR2GAA
SCHEMBL5580762 0.79 PPARG (0.53) PPARGPPARA
SCHEMBL4056042 0.78 PPARG (0.49) PPARGPPARAMAPT
SCHEMBL4389495 0.77 PPARG (0.54) PPARGPPARA
SCHEMBL5580833 0.76 PPARG (0.66) PPARGPPARAKDM4E
SCHEMBL5584075 0.74 PPARG (0.59) PPARGPPARA
SCHEMBL4065302 0.74 PPARG (0.48) PPARGPPARA
SCHEMBL4057773 0.73 PPARG (0.55) PPARGPPARAMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20070105959-A1 Cynnamyl alcohol derivative compounds and drugs containing the compounds as active ingredient ONO PHARMACEUTICAL CO., LTD. (JP) 2007-05-10 US disclosed
EP-1604971-A1 CINNAMYL ALCOHOL DERIVATIVE COMPOUNDS AND DRUGS CONTAINING THE COMPOUNDS AS THE ACTIVE INGREDIENT ONO PHARMACEUTICAL CO., LTD. (JP) 2005-12-14 EP 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-20070105959-A1 Cynnamyl alcohol derivative compounds and drugs containing the compounds as active ingredient LPL, GPR119, EBP PPARG 14/4885PPARA 8/4885BACE1 3639/4885

“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.