SCHEMBL4096505

SCHEMBL4096505

CC(C)Oc1ccc(-n2c(C(=O)O)c(Cl)c3cc(-c4ccc(C(F)(F)F)cc4)ncc32)cc1

nearest known ligand 0.44

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ PTGES O14684 3/20 0.44
▸ PPARG P37231 13/20 0.41
▸ PPARA Q07869 4/20 0.40
▸ CYP1A2 P05177 1/20 0.39
▸ MCL1 Q07820 2/20 0.39
▸ PTPN11 Q06124 1/20 0.39
▸ BCL2 P10415 1/20 0.38
▸ MDM2 Q00987 1/20 0.38

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
SCHEMBL3572273 0.89 PTGES (0.45) PTGESPPARGPPARA
SCHEMBL4107237 0.84 PTPN11 (0.50) PTGESPPARGPPARAMCL1PTPN11
SCHEMBL4228390 0.83 PPARG (0.50) PTGESPPARGPPARA
SCHEMBL4227238 0.83 PTGES (0.41) PTGESPPARGPPARACYP1A2
SCHEMBL4265118 0.83 PTGES (0.46) PTGESPPARGPPARAMCL1BCL2
SCHEMBL4090259 0.81 PTGES (0.61) PTGESCYP1A2MCL1PTPN11BCL2
SCHEMBL4916822 0.81 PPARG (0.47) PPARGPPARA
SCHEMBL4095194 0.81 PTPN11 (0.41) PTGESPPARGPPARAMCL1PTPN11
SCHEMBL4913507 0.81 PPARG (0.45) PTGESPPARGPPARA
SCHEMBL4922040 0.81 PPARG (0.46) 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 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.

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