SCHEMBL5131709

SCHEMBL5131709

CCOc1cc(CC(=O)O)cc(Oc2cccc(-c3ccc(F)c(Cl)c3)c2)c1

nearest known ligand 0.47

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
FFAR1 O14842 6/20 0.47
PPARD Q03181 3/20 0.47
RXRA P19793 2/20 0.46
RXRB P28702 2/20 0.46
RXRG P48443 1/20 0.45
THRA P10827 5/20 0.44
THRB P10828 5/20 0.44
PTGS2 P35354 1/20 0.43
FFAR4 Q5NUL3 1/20 0.42
SLC13A5 Q86YT5 1/20 0.41
PLAU P00749 1/20 0.41
ACACB O00763 1/20 0.41
ACACA Q13085 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
SCHEMBL5126835 0.92 FFAR1 (0.45) FFAR1THRATHRBFFAR4SLC13A5
SCHEMBL4430444 0.89 THRA (0.53) FFAR1PPARDRXRARXRBRXRG
SCHEMBL5126060 0.89 RXRA (0.52) FFAR1PPARDRXRARXRBRXRG
SCHEMBL5129147 0.89 FFAR1 (0.47) FFAR1PPARDTHRATHRBFFAR4
SCHEMBL4434293 0.87 THRA (0.46) FFAR1THRATHRBFFAR4PLAU
SCHEMBL5127221 0.86 PPARD (0.50) FFAR1PPARDTHRATHRBFFAR4
SCHEMBL5128966 0.86 FFAR1 (0.56) FFAR1PPARDRXRARXRBRXRG
SCHEMBL5128308 0.84 FFAR1 (0.53) FFAR1PPARDRXRARXRBRXRG
SCHEMBL5122549 0.83 FFAR1 (0.58) FFAR1PPARDRXRARXRBRXRG
SCHEMBL5128706 0.82 RXRA (0.62) FFAR1PPARDRXRARXRBRXRG

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 FFAR1 57/4885PPARD 3/4885RXRA 8/4885

“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.