SCHEMBL3578399

SCHEMBL3578399

CC(C)(C)c1ccc(-c2ccc3c(c2)cc(C(=O)O)n3-c2ccc(OC(F)(F)F)cc2)cc1

nearest known ligand 0.74

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ PTGES O14684 2/20 0.74
▸ PPARG P37231 6/20 0.51
▸ PPARA Q07869 1/20 0.51
▸ SERPINE1 P05121 1/20 0.49
▸ NTRK1 P04629 2/20 0.44
▸ TRPV1 Q8NER1 1/20 0.42
▸ GCGR P47871 1/20 0.41
▸ CCR9 P51686 1/20 0.41
▸ AURKA O14965 1/20 0.40
▸ TPX2 Q9ULW0 1/20 0.40
▸ EPHX2 P34913 1/20 0.40
▸ NR1H4 Q96RI1 1/20 0.40
▸ LDHA P00338 1/20 0.40
▸ ALDH1A1 P00352 1/20 0.40
▸ TSHR P16473 1/20 0.40

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
SCHEMBL3584093 0.89 PTGES (0.59) PTGESPPARGSERPINE1NTRK1GCGR
SCHEMBL3569788 0.88 PTGES (0.71) PTGESPPARGPPARACCR9NR1H4
SCHEMBL3567571 0.88 PTGES (0.71) PTGESPPARGPPARASERPINE1GCGR
SCHEMBL3582146 0.86 PTGES (0.56) PTGESSERPINE1NTRK1GCGRAURKA
SCHEMBL3575240 0.86 PTGES (0.76) PTGESPPARANTRK1GCGRAURKA
SCHEMBL3581438 0.85 PTGES (1.00) PTGESPPARGPPARACCR9NR1H4
SCHEMBL3568117 0.84 PTGES (0.58) PTGESPPARGPPARANTRK1GCGR
SCHEMBL3576474 0.83 PTGES (0.71) PTGESPPARGPPARACCR9NR1H4
SCHEMBL3567316 0.83 PTGES (0.71) PTGESPPARGGCGRCCR9NR1H4
Hydrochloric Acid SCHEMBL3572427 0.83 PTGES (0.62) PTGESPPARGPPARASERPINE1CCR9

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-7705023-B2 Indoles useful in the treatment of inflammation BIOLIPOX AB (SE) 2010-04-27 — — US disclosed
EP-1778632-B1 INDOLES USEFUL IN THE TREATMENT OF INFLAMMATION BIOLIPOX AB (SE) 2008-08-20 — — EP disclosed
US-20070287715-A1 Indoles Useful in the Treatment of Inflammation BIOLIPOX AB (SE) 2007-12-13 — — 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-20070287715-A1 Indoles Useful in the Treatment of Inflammation PTGS1, IDO1, PTGES PTGES 3/4885PPARG 663/4885PPARA 1067/4885

“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.

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