SCHEMBL1199906

SCHEMBL1199906

CCc1ccc(CCOc2ccc(CC(C)(Cl)C(=O)O)cc2)nc1

nearest known ligand 0.53

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
PPARG P37231 12/20 0.53
CYP3A4 P08684 1/20 0.52
RXRA P19793 1/20 0.52
CYP4F2 P78329 1/20 0.45
CYP4A11 Q02928 1/20 0.45
LMNA P02545 2/20 0.43
ALDH1A1 P00352 1/20 0.43
PPARA Q07869 10/20 0.42
PPARD Q03181 8/20 0.42
L3MBTL1 Q9Y468 1/20 0.39

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
SCHEMBL1201522 0.88 PPARG (0.53) PPARGCYP3A4RXRACYP4F2CYP4A11
SCHEMBL24209462 0.83 PPARG (0.54) PPARGCYP3A4RXRACYP4F2CYP4A11
SCHEMBL5802964 0.81 PPARG (0.51) PPARGCYP3A4RXRACYP4F2CYP4A11
SCHEMBL943063 0.81 PPARG (0.58) PPARGCYP3A4RXRAALDH1A1
SCHEMBL6509358 0.81 PPARG (0.46) PPARGCYP3A4RXRACYP4F2CYP4A11
SCHEMBL6509355 0.81 PPARG (0.46) PPARGCYP3A4RXRACYP4F2CYP4A11
SCHEMBL1162595 0.80 LMNA (0.63) PPARGCYP3A4RXRACYP4F2CYP4A11
SCHEMBL6383438 0.79 PPARG (0.47) PPARGCYP3A4RXRACYP4F2CYP4A11
SCHEMBL6383648 0.79 PPARG (0.47) PPARGCYP3A4RXRACYP4F2CYP4A11
SCHEMBL6383447 0.79 PPARG (0.47) PPARGCYP3A4RXRACYP4F2CYP4A11

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2310367-A1 A PROCESS FOR THE PREPARATION OF 4-Ý2-(5-ETHYL-2-PYRIDYL)ETHOXY¨NITROBENZENE AND PIOGLITAZONE ERREGIERRE S.p.A. (IT) 2011-04-20 EP claimed
US-20110046382-A1 PROCESS FOR THE PREPARATION OF 4-[2-(5-ETHYL-2-PYRIDYL)ETHOXY]NITROBENZENE AND PIOGLITAZONE ERREGIERRE S.P.A. (IT) 2011-02-24 US claimed
WO-2009133576-A1 A PROCESS FOR THE PREPARATION OF 4-[2-(5-ETHYL-2-PYRIDYL)ETHOXY]NITROBENZENE AND PIOGLITAZONE ERREGIERRE S.P.A. (IT) 2009-11-05 WO claimed
EP-2310367-A1 A PROCESS FOR THE PREPARATION OF 4-Ý2-(5-ETHYL-2-PYRIDYL)ETHOXY¨NITROBENZENE AND PIOGLITAZONE ERREGIERRE S.p.A. (IT) 2011-04-20 EP disclosed
US-20110046382-A1 PROCESS FOR THE PREPARATION OF 4-[2-(5-ETHYL-2-PYRIDYL)ETHOXY]NITROBENZENE AND PIOGLITAZONE ERREGIERRE S.P.A. (IT) 2011-02-24 US disclosed
WO-2009133576-A1 A PROCESS FOR THE PREPARATION OF 4-[2-(5-ETHYL-2-PYRIDYL)ETHOXY]NITROBENZENE AND PIOGLITAZONE ERREGIERRE S.P.A. (IT) 2009-11-05 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-20110046382-A1 PROCESS FOR THE PREPARATION OF 4-[2-(5-ETHYL-2-PYRIDYL)ETHOXY]NITROBENZENE AND PIOGLITAZONE HNF4A, PPARA, CYP2E1 PPARG 7/4885CYP3A4 11/4885RXRA 712/4885

“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.