SCHEMBL5129224

SCHEMBL5129224

CCCOc1cc(CC(=O)O)cc(Oc2cccc(-c3ccc(OC(F)(F)F)cc3)c2)c1

nearest known ligand 0.50

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
FFAR4 Q5NUL3 3/20 0.50
FFAR1 O14842 2/20 0.50
THRA P10827 2/20 0.49
THRB P10828 2/20 0.49
SLC13A5 Q86YT5 2/20 0.48
ACACB O00763 2/20 0.45
ACACA Q13085 2/20 0.45
RXRA P19793 2/20 0.43
RXRB P28702 1/20 0.43
RXRG P48443 1/20 0.43
HDAC1 Q13547 1/20 0.43
HDAC2 Q92769 1/20 0.43
PLA2G4B P0C869 1/20 0.42
PTGER4 P35408 1/20 0.41
MME P08473 1/20 0.41
PPARD Q03181 2/20 0.41
FABP1 P07148 1/20 0.41
NR1H2 P55055 1/20 0.41
NR1H3 Q13133 1/20 0.41

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
SCHEMBL5132497 0.95 THRA (0.52) FFAR4FFAR1THRATHRBSLC13A5
SCHEMBL5126507 0.92 RXRA (0.53) FFAR4FFAR1THRATHRBSLC13A5
SCHEMBL5122441 0.91 FFAR4 (0.52) FFAR4FFAR1THRATHRBSLC13A5
SCHEMBL5131833 0.89 RXRA (0.52) FFAR4FFAR1THRATHRBSLC13A5
SCHEMBL5128475 0.88 FFAR1 (0.56) FFAR4FFAR1THRATHRBSLC13A5
SCHEMBL4441015 0.88 FFAR1 (0.54) FFAR4FFAR1THRATHRBSLC13A5
SCHEMBL5132377 0.88 FFAR1 (0.62) FFAR4FFAR1THRATHRBSLC13A5
SCHEMBL5129213 0.86 THRA (0.53) FFAR4FFAR1THRATHRBSLC13A5
SCHEMBL5132000 0.86 RXRA (0.50) FFAR4FFAR1THRATHRBSLC13A5
SCHEMBL5122986 0.86 THRA (0.51) FFAR4FFAR1THRATHRBSLC13A5

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20080249137-A1 PPAR active compounds PLEXXIKON INC 2008-10-09 US disclosed
US-20080249137-A1 PPAR active compounds PLEXXIKON INC 2008-10-09 US disclosed
US-20080249137-A1 PPAR active compounds PLEXXIKON INC 2008-10-09 US disclosed
WO-2007030567-A2 PPARACTIVE COMPOUNDS PLEXXIKON, INC. (US) 2007-03-15 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 (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-20080249137-A1 PPAR active compounds PPARG, PPARA, PPARD FFAR4 60/4885FFAR1 57/4885THRA 228/4885

“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.