SCHEMBL2299993

SCHEMBL2299993

O=C(O)COc1ccc(OCc2ccc(-c3ccccc3)nc2OC2CCCCC2)cc1

nearest known ligand 0.52

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
FFAR4 Q5NUL3 6/20 0.52
ACACA Q13085 1/20 0.43
PPARG P37231 1/20 0.43
PPARD Q03181 1/20 0.43
MEN1 O00255 3/20 0.42
KMT2A Q03164 3/20 0.42
ALOX15 P16050 1/20 0.39
CPT1A P50416 1/20 0.39
THRA P10827 1/20 0.38
THRB P10828 1/20 0.38
ALOX5 P09917 1/20 0.38
PTGDR2 Q9Y5Y4 1/20 0.38
VCP P55072 1/20 0.38

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
SCHEMBL2300943 0.81 ALDH1A1 (0.50) FFAR4ACACAPPARGPPARDMEN1
SCHEMBL14931854 0.78 FFAR4 (0.47) FFAR4ACACAPPARGPPARDMEN1
SCHEMBL12427067 0.78 FFAR4 (0.38) FFAR4
SCHEMBL2299079 0.77 ACACA (0.45) FFAR4ACACAPPARGPPARDMEN1
SCHEMBL2300444 0.76 PLA2G4B (0.50) FFAR4ACACAPPARGPPARD
SCHEMBL14931918 0.74 ALDH1A1 (0.49) FFAR4MEN1KMT2A
SCHEMBL2300159 0.73 FFAR4 (0.48) FFAR4ACACAPPARGPPARDMEN1
SCHEMBL2298720 0.69 PPARD (0.57) PPARGPPARDPTGDR2
SCHEMBL2298241 0.68 FFAR1 (0.48) ACACAPPARGPPARDMEN1KMT2A
SCHEMBL17882521 0.68 FFAR4 (1.00) FFAR4PPARD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8461183-B2 PPAR agonist compounds, preparation and uses GENFIT (FR) 2013-06-11 US claimed
EP-2310371-B1 PPAR AGONIST COMPOUNDS AND PREPARATION AND USES THEREOF FOR TREATING DIABETES AND/OR DYSLIPIDEMIA GENFIT (FR) 2013-05-15 EP claimed
US-20110195993-A1 PPAR AGONIST COMPOUNDS, PREPARATION AND USES GENFIT (FR) 2011-08-11 US claimed
WO-2016149299-A1 THERAPEUTIC COMPOUNDS THAT SUPPRESS PROTEIN ARGININE METHYLTRANSFERASE ACTIVITY FOR REDUCING TUMOR CELL PROLIFERATION EPINOVA THERAPEUTICS CORP. (US) 2016-09-22 WO disclosed
US-20160271149-A1 THERAPEUTIC COMPOUNDS THAT SUPPRESS PROTEIN ARGININE METHYLTRANSFERASE ACTIVITY FOR REDUCING TUMOR CELL PROLIFERATION EPINOVA THERAPEUTICS CORP. 2016-09-22 US disclosed
US-8461183-B2 PPAR agonist compounds, preparation and uses GENFIT (FR) 2013-06-11 US disclosed
EP-2310371-B1 PPAR AGONIST COMPOUNDS AND PREPARATION AND USES THEREOF FOR TREATING DIABETES AND/OR DYSLIPIDEMIA GENFIT (FR) 2013-05-15 EP disclosed
US-20110195993-A1 PPAR AGONIST COMPOUNDS, PREPARATION AND USES GENFIT (FR) 2011-08-11 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-20110195993-A1 PPAR AGONIST COMPOUNDS, PREPARATION AND USES PPARD, PPARA, PPARG FFAR4 6/4885ACACA 147/4885PPARG 3/4885

“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.