SCHEMBL4095174

SCHEMBL4095174

CC(C)Oc1ccc(-n2c(C(=O)O)cc3cc(Oc4cccc(C(F)(F)F)c4)ncc32)cc1

nearest known ligand 0.51

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
PTGES O14684 2/20 0.51
PPARG P37231 13/20 0.45
PPARA Q07869 4/20 0.44
GAA P10253 2/20 0.44
RAB9A P51151 1/20 0.42
MAPT P10636 2/20 0.41
MAPK1 P28482 1/20 0.41
TDP1 Q9NUW8 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.41

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
SCHEMBL4097225 0.89 KDM4E (0.47) PTGESPPARGPPARAGAARAB9A
SCHEMBL4921606 0.87 PTGES (0.61) PTGESPPARGPPARA
SCHEMBL4095050 0.86 PTGES (0.48) PTGESPPARGPPARA
SCHEMBL4228522 0.84 PTGES (0.59) PTGES
SCHEMBL4089140 0.83 PPARG (0.46) PTGESPPARGPPARAMAPT
SCHEMBL4923306 0.82 PTGES (0.52) PTGES
SCHEMBL4090259 0.80 PTGES (0.61) PTGES
SCHEMBL4089205 0.80 PTGES (0.56) PTGESPPARGPPARAMAPT
Water SCHEMBL4923346 0.78 PTGES (0.66) PTGESPPARGPPARAGAA
Water SCHEMBL4923358 0.78 PTGES (0.66) PTGESPPARGPPARAGAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090048285-A1 Pyrrolopyridines Useful in the Treatment of Inflammation BIOLIPOX AB (SE) 2009-02-19 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-20090048285-A1 Pyrrolopyridines Useful in the Treatment of Inflammation PYCR1, ARG2, ARG1 PTGES 47/4885PPARG 1316/4885PPARA 2331/4885

“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.