SCHEMBL4698604

SCHEMBL4698604

CC(C)Oc1ccc(-n2c(C(=O)O)c(N3CCOCC3)c3cc(-c4ccc(C(F)(F)F)cc4)ccc32)cc1

nearest known ligand 0.47

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
PTGES O14684 3/20 0.47
PPARG P37231 11/20 0.41
PPARA Q07869 4/20 0.40
ALOX15 P16050 1/20 0.39
HSD17B10 Q99714 1/20 0.39
LMNA P02545 1/20 0.38
MAPT P10636 1/20 0.38
ALDH1A1 P00352 1/20 0.38
GLA P06280 1/20 0.38
POLB P06746 1/20 0.37
AKR1C3 P42330 1/20 0.37

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
SCHEMBL4700259 0.90 BTK (0.41) PTGESPPARGPPARAHSD17B10LMNA
SCHEMBL27679338 0.79 BTK (0.40) ALOX15HSD17B10LMNAMAPTALDH1A1
SCHEMBL3000561 0.79 PTGES (0.55) PTGESPPARGPPARAALOX15HSD17B10
SCHEMBL3578280 0.75 PTGES (0.53) PTGESALDH1A1
SCHEMBL4701667 0.75 PTGES (0.46) PTGESPPARGPPARAMAPT
SCHEMBL4916712 0.75 PPARG (0.44) PTGESPPARGPPARAMAPT
SCHEMBL5319899 0.75 PPARG (0.50) PTGESPPARGPPARA
SCHEMBL4027503 0.74 PTGES (0.71) PTGESPPARGPPARA
SCHEMBL1407250 0.74 PPARG (0.51) PTGESPPARGPPARA
SCHEMBL3007431 0.74 PTGES (0.49) PTGESPPARGPPARA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1778633-B1 INDOLES USEFUL IN THE TREATMENT OF INFLAMMATION BIOLIPOX AB (SE) 2008-12-03 EP disclosed
US-20080188473-A1 Indoles Useful in the Treatment of Inflammation BIOLIPOX AB (SE) 2008-08-07 US disclosed
EP-1778633-A1 INDOLES USEFUL IN THE TREATMENT OF INFLAMMATION Biolipox AB (SE) 2007-05-02 EP disclosed
WO-2005123674-A1 INDOLES USEFUL IN THE TREATMENT OF INFLAMMATION BIOLIPOX AB (SE) 2005-12-29 WO 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-20080188473-A1 Indoles Useful in the Treatment of Inflammation IDO1, PTGS1, PTGER1 PTGES 4/4885PPARG 753/4885PPARA 1228/4885

“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.