SCHEMBL2167541

SCHEMBL2167541

CC(COc1ccc(Oc2ccc(OCc3ccccc3)cc2)cc1)N(C(=O)O)C(C)(C)C

nearest known ligand 0.52

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
PPARG P37231 2/20 0.52
MAOB P27338 2/20 0.49
ACACB O00763 1/20 0.49
PPARD Q03181 1/20 0.48
PPARA Q07869 1/20 0.48
ALOX5 P09917 4/20 0.48
PTGS1 P23219 1/20 0.48
PTGS2 P35354 1/20 0.48
L3MBTL1 Q9Y468 2/20 0.47
PRKCA P17252 1/20 0.46
PRKCD Q05655 1/20 0.46
LMNA P02545 1/20 0.46
FFAR1 O14842 1/20 0.46
FFAR4 Q5NUL3 1/20 0.46
NR4A1 P22736 1/20 0.46
NR4A2 P43354 1/20 0.46
NR4A3 Q92570 1/20 0.46
LTA4H P09960 1/20 0.45

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
SCHEMBL28934594 0.86 LMNA (0.50) PTGS1LMNA
SCHEMBL28934593 0.86 LMNA (0.50) PTGS1LMNA
SCHEMBL2547814 0.83 SLC6A2 (0.42) PTGS1LTA4H
SCHEMBL23929198 0.78 PTGES (0.55) MAOBALOX5FFAR1NR4A1NR4A2
SCHEMBL23929196 0.78 PTGES (0.55) MAOBALOX5FFAR1NR4A1NR4A2
SCHEMBL2551232 0.77 ITGB3 (0.41) MAOBLMNA
SCHEMBL4234514 0.76 ALOX5 (0.55) PPARGMAOBPPARDPPARAALOX5
SCHEMBL771564 0.75 MAOB (0.51) PPARGMAOBPPARDPPARAALOX5
SCHEMBL771563 0.75 MAOB (0.51) PPARGMAOBPPARDPPARAALOX5
SCHEMBL2167172 0.74 ACACB (0.59) ACACB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20110183998-A1 HETEROCYCLIC COMPOUNDS, PROCESSES FOR THEIR PREPARATION, MEDICAMENTS COMPRISING THESE COMPOUNDS, AND THE USE THEREOF SANOFI-AVENTIS (FR) 2011-07-28 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-20110183998-A1 HETEROCYCLIC COMPOUNDS, PROCESSES FOR THEIR PREPARATION, MEDICAMENTS COMPRISING THESE COMPOUNDS, AND THE USE THEREOF CS, CYP11B1, GPR119 PPARG 122/4885MAOB 126/4885ACACB 1290/4885

“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.