SCHEMBL5129079

SCHEMBL5129079

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

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FFAR4 Q5NUL3 3/20 0.51
FFAR1 O14842 2/20 0.51
SLC13A5 Q86YT5 1/20 0.48
ACACB O00763 2/20 0.45
ACACA Q13085 2/20 0.45
FABP1 P07148 1/20 0.43
THRA P10827 4/20 0.43
THRB P10828 4/20 0.43
PLA2G4B P0C869 1/20 0.43
CTSA P10619 1/20 0.42
RXRA P19793 1/20 0.42
RXRB P28702 1/20 0.42
KMT2A Q03164 1/20 0.41
PTPN11 Q06124 2/20 0.41
P2RX3 P56373 1/20 0.40
ROCK2 O75116 1/20 0.40
CYP3A4 P08684 1/20 0.40
CYP2D6 P10635 1/20 0.40
CYP2C9 P11712 1/20 0.40
ROCK1 Q13464 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
SCHEMBL5126060 0.91 RXRA (0.52) FFAR4FFAR1SLC13A5ACACBACACA
SCHEMBL5129447 0.90 FFAR4 (0.53) FFAR4FFAR1SLC13A5ACACBACACA
SCHEMBL5126835 0.90 FFAR1 (0.45) FFAR4FFAR1SLC13A5ACACBACACA
SCHEMBL5128475 0.89 FFAR1 (0.56) FFAR4FFAR1SLC13A5ACACBACACA
SCHEMBL5132377 0.89 FFAR1 (0.62) FFAR4FFAR1SLC13A5ACACBACACA
SCHEMBL4440031 0.86 FFAR1 (0.55) FFAR4FFAR1SLC13A5THRATHRB
SCHEMBL5131833 0.86 RXRA (0.52) FFAR4FFAR1SLC13A5ACACBACACA
SCHEMBL5129224 0.85 FFAR4 (0.50) FFAR4FFAR1SLC13A5ACACBACACA
SCHEMBL5132497 0.84 THRA (0.52) FFAR4FFAR1SLC13A5FABP1THRA
SCHEMBL4433185 0.84 PTGDR2 (0.51) FFAR4FFAR1THRATHRBP2RX3

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 57/4885SLC13A5 4696/4885

“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.