SCHEMBL333848

SCHEMBL333848

O=C(O)CCc1c(C(=O)O)n(-c2ccc(OC3CCCC3)cc2)c2ccc(-c3ccc(C(F)(F)F)cc3)cc12

nearest known ligand 0.40

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
PPARG P37231 9/20 0.40
PPARA Q07869 6/20 0.40
FFAR4 Q5NUL3 5/20 0.38
PPARD Q03181 2/20 0.37
LIPG Q9Y5X9 3/20 0.36
LIPC P11150 1/20 0.36

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
Hydrochloric Acid SCHEMBL3001723 0.89 PPARG (0.39) PPARGPPARAFFAR4PPARDLIPG
Ammonia Solution, Strong SCHEMBL3001720 0.89 PPARG (0.39) PPARGPPARAPPARDLIPGLIPC
SCHEMBL3011927 0.89 PPARG (0.39) PPARGPPARALIPGLIPC
SCHEMBL1407025 0.89 PPARG (0.41) PPARGPPARALIPG
SCHEMBL3003319 0.89 PPARG (0.38) PPARGPPARAFFAR4PPARD
SCHEMBL334044 0.86 PPARG (0.43) PPARGPPARALIPGLIPC
SCHEMBL333503 0.83 PPARG (0.41) PPARGPPARA
SCHEMBL333327 0.83 ACACB (0.38) PPARGPPARA
SCHEMBL3013914 0.81 P2RY14 (0.37) PPARGPPARAFFAR4PPARD
SCHEMBL334231 0.80 PPARG (0.41) PPARGPPARAPPARD

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 2451/4885PPARA 3590/4885FFAR4 2377/4885

“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.