SCHEMBL4107237

SCHEMBL4107237

CC(C)Oc1ccc(-n2c(C(=O)O)c(Cl)c3cc(-c4ccc(C(F)(F)F)cc4)cnc32)cc1

nearest known ligand 0.50

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ PTPN11 Q06124 3/20 0.50
▸ PTGES O14684 2/20 0.44
▸ PPARG P37231 7/20 0.43
▸ CYP3A4 P08684 1/20 0.39
▸ CYP3A5 P20815 1/20 0.39
▸ PPARA Q07869 1/20 0.39
▸ PTPN5 P54829 1/20 0.38
▸ PPARD Q03181 1/20 0.38
▸ BCL2 P10415 1/20 0.38
▸ MDM2 Q00987 1/20 0.38
▸ MCL1 Q07820 1/20 0.38
▸ SCN9A Q15858 2/20 0.38
▸ EGLN1 Q9GZT9 1/20 0.38
▸ MAP4K4 O95819 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
SCHEMBL4095194 0.90 PTPN11 (0.41) PTPN11PTGESPPARGCYP3A4CYP3A5
SCHEMBL4094952 0.90 PTPN11 (0.51) PTPN11PTGESPPARGCYP3A4CYP3A5
SCHEMBL4096505 0.84 PTGES (0.44) PTPN11PTGESPPARGPPARABCL2
SCHEMBL3572273 0.81 PTGES (0.45) PTGESPPARGPPARA
SCHEMBL4100038 0.80 PTGES (0.60) PTPN11PTGESCYP3A4CYP3A5PTPN5
SCHEMBL4228390 0.77 PPARG (0.50) PTGESPPARGPPARA
SCHEMBL4916822 0.76 PPARG (0.47) PPARGPPARASCN9A
SCHEMBL4104398 0.76 PPARG (0.41) PTPN11PTGESPPARGPPARAPPARD
SCHEMBL4227238 0.76 PTGES (0.41) PTGESPPARGPPARAPTPN5
SCHEMBL4913507 0.76 PPARG (0.45) 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 PTPN11 1154/4885PTGES 47/4885PPARG 1316/4885

“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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