SCHEMBL4432446

SCHEMBL4432446

CCOc1ccc(-c2cccc(Oc3cccc(CC(=O)O)c3)c2)c(C)c1

nearest known ligand 0.54

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
FFAR1 O14842 10/20 0.52
PTPN11 Q06124 1/20 0.51
PLA2G4B P0C869 1/20 0.47
PPARD Q03181 2/20 0.46
RXRA P19793 1/20 0.46
RXRB P28702 1/20 0.46
PTGS2 P35354 1/20 0.46
SRD5A2 P31213 1/20 0.45
PPARG P37231 1/20 0.45
PPARA Q07869 1/20 0.45
THRA P10827 2/20 0.44
THRB P10828 2/20 0.44

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
SCHEMBL4434998 0.88 FFAR1 (0.57) FFAR1PTPN11PLA2G4BPPARDRXRA
SCHEMBL4433415 0.84 RXRA (0.58) FFAR1PLA2G4BPPARDRXRARXRB
SCHEMBL4430002 0.84 SUCNR1 (0.51) FFAR1SRD5A2THRATHRB
SCHEMBL4428893 0.84 PPARG (0.48) FFAR1PTPN11PTGS2SRD5A2PPARG
SCHEMBL4439770 0.84 FFAR1 (0.50) FFAR1PTPN11PPARDPPARGPPARA
SCHEMBL4214472 0.81 RXRA (0.62) FFAR1PTPN11PLA2G4BPPARDRXRA
SCHEMBL2458898 0.81 PLA2G4B (0.59) PLA2G4BPPARDRXRARXRBPPARG
SCHEMBL4435379 0.79 THRA (0.56) FFAR1PTPN11PPARDRXRARXRB
SCHEMBL5128966 0.78 FFAR1 (0.56) FFAR1PPARDRXRARXRBTHRA
SCHEMBL4433168 0.76 FFAR1 (0.52) FFAR1PPARDPTGS2

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 6 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
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 FFAR1 30/4885PTPN11 1568/4885PLA2G4B 753/4885

“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.