SCHEMBL4433415

SCHEMBL4433415

CCOc1ccc(-c2cccc(Oc3cccc(CC(=O)O)c3)c2)cc1

nearest known ligand 0.61

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
RXRA P19793 2/20 0.58
RXRB P28702 2/20 0.58
FFAR1 O14842 6/20 0.56
FFAR4 Q5NUL3 3/20 0.56
PPARD Q03181 2/20 0.51
PLA2G4B P0C869 1/20 0.51
SLC13A5 Q86YT5 1/20 0.51
RXRG P48443 1/20 0.50
FABP1 P07148 1/20 0.47
THRA P10827 1/20 0.47
THRB P10828 1/20 0.47

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
SCHEMBL5128966 0.93 FFAR1 (0.56) RXRARXRBFFAR1FFAR4PPARD
SCHEMBL4435373 0.89 FFAR1 (0.61) RXRARXRBFFAR1FFAR4PPARD
SCHEMBL5128475 0.87 FFAR1 (0.56) RXRARXRBFFAR1FFAR4PPARD
SCHEMBL5122549 0.87 FFAR1 (0.58) RXRARXRBFFAR1FFAR4PPARD
SCHEMBL4433180 0.87 FFAR1 (0.60) FFAR1FFAR4SLC13A5THRATHRB
SCHEMBL4214472 0.86 RXRA (0.62) RXRARXRBFFAR1PPARDPLA2G4B
SCHEMBL5123879 0.85 FFAR1 (0.57) RXRARXRBFFAR1FFAR4PPARD
SCHEMBL4212932 0.85 RXRA (0.69) RXRARXRBFFAR1PPARDSLC13A5
SCHEMBL4432446 0.84 FFAR1 (0.52) RXRARXRBFFAR1PPARDPLA2G4B
SCHEMBL5126060 0.84 RXRA (0.52) RXRARXRBFFAR1FFAR4PPARD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2121591-A2 PPAR ACTIVE COMPOUNDS PLEXXIKON, INC. (US) 2009-11-25 EP disclosed
WO-2008109697-A2 PPAR ACTIVE COMPOUNDS PLEXXIKON, INC. (US) 2008-09-12 WO disclosed
US-20080221127-A1 peroxisome proliferator-activated receptor agonists; congestive heart failure, atherosclerosis, arteriosclerosis, obesity, hyperlipidemia, hypoalphalipoproteinemia, Syndrome X, diabetes, insulin resistance PLEXXIKON INC 2008-09-11 US disclosed
US-20080221127-A1 peroxisome proliferator-activated receptor agonists; congestive heart failure, atherosclerosis, arteriosclerosis, obesity, hyperlipidemia, hypoalphalipoproteinemia, Syndrome X, diabetes, insulin resistance PLEXXIKON INC 2008-09-11 US disclosed
US-20080221127-A1 peroxisome proliferator-activated receptor agonists; congestive heart failure, atherosclerosis, arteriosclerosis, obesity, hyperlipidemia, hypoalphalipoproteinemia, Syndrome X, diabetes, insulin resistance PLEXXIKON INC 2008-09-11 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-20080221127-A1 peroxisome proliferator-activated receptor agonists; congestive heart failure, atherosclerosis, arteriosclerosis, obesity, hyperlipidemia, hypoalphalipoproteinemia, Syndrome X, diabetes, insulin resistance PPARA, PPARG, PPARD RXRA 13/4885RXRB 14/4885FFAR1 30/4885

“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.