SCHEMBL4428893

SCHEMBL4428893

Cc1cc(F)ccc1-c1cccc(Oc2cccc(CC(=O)O)c2)c1

nearest known ligand 0.57

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
PPARG P37231 3/20 0.48
FFAR1 O14842 4/20 0.46
FAAH O00519 1/20 0.45
PTGS2 P35354 1/20 0.45
SRD5A2 P31213 1/20 0.44
THRA P10827 4/20 0.43
THRB P10828 4/20 0.43
NR3C1 P04150 1/20 0.43
DHODH Q02127 1/20 0.43
PLAU P00749 1/20 0.43
PTPN11 Q06124 1/20 0.43
PTGDR2 Q9Y5Y4 1/20 0.42

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
SCHEMBL4439747 0.90 THRA (0.49) PPARGFFAR1THRATHRBNR3C1
SCHEMBL4427574 0.88 PTGS2 (0.52) PPARGFFAR1FAAHPTGS2SRD5A2
SCHEMBL4430002 0.86 SUCNR1 (0.51) FFAR1SRD5A2THRATHRBPTGDR2
SCHEMBL4431706 0.86 THRA (0.49) PPARGFFAR1FAAHPTGS2THRA
SCHEMBL4432446 0.84 FFAR1 (0.52) PPARGFFAR1PTGS2SRD5A2THRA
SCHEMBL4440065 0.83 NR3C1 (0.52) PPARGFFAR1SRD5A2THRATHRB
SCHEMBL4441221 0.82 MRGPRX4 (0.56) FFAR1SRD5A2THRATHRBNR3C1
SCHEMBL4433218 0.81 FFAR4 (0.48) FFAR1FAAHPTGS2SRD5A2THRA
SCHEMBL4431702 0.81 PLAU (0.47) FFAR1FAAHPTGS2SRD5A2THRA
SCHEMBL4435039 0.80 FFAR1 (0.53) PPARGFFAR1FAAHPTGS2SRD5A2

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 PPARG 2/4885FFAR1 30/4885FAAH 954/4885

“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.