SCHEMBL334231

SCHEMBL334231

CCOC(=O)c1c(C(=O)O)c2cc(-c3ccc(C(F)(F)F)cc3)ccc2n1-c1ccc(OC2CCCC2)cc1

nearest known ligand 0.41

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
PPARG P37231 4/20 0.41
PPARA Q07869 3/20 0.41
THRB P10828 2/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
MEN1 O00255 2/20 0.39
KMT2A Q03164 2/20 0.39
P2RY14 Q15391 2/20 0.38
EPHX2 P34913 1/20 0.38
TP53 P04637 2/20 0.38
MAPT P10636 2/20 0.38
FAAH O00519 1/20 0.37
ALOX5 P09917 1/20 0.37
PPARD Q03181 1/20 0.36
AKR1C3 P42330 1/20 0.36
AKR1C2 P52895 1/20 0.36
ADRB2 P07550 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
SCHEMBL333883 0.90 FAAH (0.38) PPARGPPARATHRBSMN1; SMN2P2RY14
SCHEMBL334044 0.90 PPARG (0.43) PPARGPPARAEPHX2
SCHEMBL3013914 0.86 P2RY14 (0.37) PPARGPPARAP2RY14EPHX2FAAH
SCHEMBL3010652 0.84 AKR1C3 (0.35) PPARGPPARAP2RY14EPHX2FAAH
SCHEMBL3010730 0.84 FAAH (0.35) PPARGPPARATHRBSMN1; SMN2P2RY14
SCHEMBL3010732 0.84 FAAH (0.35) PPARGPPARATHRBSMN1; SMN2P2RY14
SCHEMBL3012527 0.84 PPARA (0.38) PPARGPPARAP2RY14MAPTFAAH
SCHEMBL3112196 0.83 FAAH (0.36) PPARGPPARAP2RY14EPHX2FAAH
SCHEMBL3112189 0.83 FAAH (0.36) PPARGPPARAP2RY14EPHX2FAAH
SCHEMBL1407025 0.81 PPARG (0.41) PPARGPPARAEPHX2ADRB2

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 3590/4885THRB 575/4885

“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.