SCHEMBL4433405

SCHEMBL4433405

Cc1cc(F)ccc1-c1cccc(S(=O)(=O)c2cccc(CC(=O)O)c2)c1

nearest known ligand 0.44

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
PTGDR2 Q9Y5Y4 7/20 0.43
FFAR1 O14842 6/20 0.41
PTGDR Q13258 2/20 0.40
PLA2G10 O15496 1/20 0.40
PLA2G2A P14555 1/20 0.40
TRIM24 O15164 1/20 0.39
SHMT1 P34896 1/20 0.39
BACE1 P56817 1/20 0.39
PPARG P37231 1/20 0.38

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
SCHEMBL4440053 0.86 SUCNR1 (0.50) PTGDR2FFAR1PLA2G10PLA2G2ASHMT1
SCHEMBL4440751 0.84 KAT6A (0.45) PTGDR2FFAR1PTGDR
SCHEMBL4437914 0.83 MMP1 (0.50) PTGDR2
SCHEMBL4439770 0.82 FFAR1 (0.50) FFAR1PPARG
SCHEMBL4428870 0.81 GRIN2D (0.41) PTGDR2
SCHEMBL4431262 0.81 FFAR1 (0.52) FFAR1PLA2G10PLA2G2A
SCHEMBL4428893 0.80 PPARG (0.48) PTGDR2FFAR1PPARG
SCHEMBL4428862 0.80 FFAR1 (0.43) PTGDR2FFAR1PLA2G10PLA2G2A
SCHEMBL4440778 0.79 SHMT1 (0.48) PTGDR2FFAR1PLA2G10PLA2G2ASHMT1
SCHEMBL4430126 0.79 FFAR1 (0.50) PTGDR2FFAR1

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 PTGDR2 626/4885FFAR1 30/4885PTGDR 492/4885

“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.