SCHEMBL333845

SCHEMBL333845

O=C(O)Cc1c(C(=O)O)c2cc(Oc3cccc(Cl)c3)ccc2n1-c1ccc(OC(F)(F)F)cc1

nearest known ligand 0.42

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
PPARG P37231 12/20 0.42
USP14 P54578 1/20 0.42
PPARA Q07869 3/20 0.40
FFAR1 O14842 1/20 0.39
PTGES O14684 2/20 0.39
THRA P10827 1/20 0.39
THRB P10828 1/20 0.39
KDM4E B2RXH2 1/20 0.38
HIF1A Q16665 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
SCHEMBL4171314 0.93 PPARG (0.42) PPARGUSP14PTGESTHRATHRB
SCHEMBL333879 0.93 PPARG (0.41) PPARGUSP14PPARAKDM4EHIF1A
SCHEMBL333656 0.92 PPARG (0.43) PPARGUSP14PPARATHRATHRB
SCHEMBL333611 0.92 PPARG (0.47) PPARGUSP14PPARAPTGESKDM4E
SCHEMBL10076916 0.91 PPARG (0.47) PPARGUSP14PPARATHRBKDM4E
SCHEMBL333835 0.89 KDM4E (0.47) USP14FFAR1PTGESTHRBKDM4E
SCHEMBL1407175 0.89 PPARG (0.39) PPARGUSP14PPARAFFAR1THRA
SCHEMBL334342 0.86 USP14 (0.45) PPARGUSP14PPARAFFAR1PTGES
SCHEMBL333774 0.86 PPARG (0.46) PPARGPPARA
SCHEMBL333497 0.85 USP14 (0.44) PPARGUSP14PPARAFFAR1PTGES

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8097623-B2 1-Aryl-or heteroaryl-3-aryl-or heteroarylindole-2-carboxylic acids or esters: e.g., 5-(4-tert-Butylphenyl)-1,3-bis(4-isopropoxyphenyl)-indole-2-carboxylic acid; inhibition of the activity of microsomal prostaglandin E synthase-1, leukotriene C4 and/or 5-lipoxygenase-activating protein; analgesics BIOLIPOX AB (SE) 2012-01-17 US disclosed
EP-1841735-B1 INDOLES USEFUL IN THE TREATMENT OF INFLAMMATION BIOLIPOX AB (SE) 2011-03-09 EP disclosed
US-20090076004-A1 Indoles Useful in the Treatment of Inflammation BIOLIPOX AB (SE) 2009-03-19 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-20090076004-A1 Indoles Useful in the Treatment of Inflammation IDO1, IDO2, AREG PPARG 2451/4885USP14 3873/4885PPARA 3590/4885

“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.