SCHEMBL502890

SCHEMBL502890

Cn1c(COc2cccc(C(=O)O)c2)nc2ccc(Oc3ncc(Cl)cc3Cl)cc21

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
PPARG P37231 20/20 1.00

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
SCHEMBL502834 0.92 PPARG (1.00) PPARG
SCHEMBL502611 0.91 PPARG (1.00) PPARG
SCHEMBL503071 0.91 PPARG (0.84) PPARG
SCHEMBL470987 0.89 PPARG (1.00) PPARG
SCHEMBL3487330 0.87 PPARG (1.00) PPARG
Hydrochloric Acid SCHEMBL3488274 0.86 PPARG (1.00) PPARG
SCHEMBL3488913 0.86 PPARG (1.00) PPARG
SCHEMBL502814 0.85 PPARG (1.00) PPARG
Hydrochloric Acid SCHEMBL3487540 0.85 PPARG (1.00) PPARG
SCHEMBL502581 0.85 PPARG (0.81) PPARG

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 21 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2404918-B1 PYRIDINE DERIVATIVE AS PPARY INHIBITOR DAIICHI SANKYO CO LTD (JP) 2016-11-30 EP claimed
US-20120029026-A1 PYRIDINE DERIVATIVE DAIICHI SANKYO COMPANY, LIMITED (JP) 2012-02-02 US claimed
EP-2404918-A1 PYRIDINE DERIVATIVE Daiichi Sankyo Company, Limited (JP) 2012-01-11 EP claimed
EP-2404918-B1 PYRIDINE DERIVATIVE AS PPARY INHIBITOR DAIICHI SANKYO CO LTD (JP) 2016-11-30 EP disclosed
EP-2404918-B1 PYRIDINE DERIVATIVE AS PPARY INHIBITOR DAIICHI SANKYO CO LTD (JP) 2016-11-30 EP disclosed
US-8946264-B2 Pyridine derivative DAIICHI SANKYO COMPANY, LIMITED (JP) 2015-02-03 US disclosed
US-8946264-B2 Pyridine derivative DAIICHI SANKYO COMPANY, LIMITED (JP) 2015-02-03 US disclosed
US-8946264-B2 Pyridine derivative DAIICHI SANKYO COMPANY, LIMITED (JP) 2015-02-03 US disclosed
US-20130204009-A1 PROCESS FOR PREPARING BENZOIC ACID ESTERS DAIICHI SANKYO COMPANY, LIMITED (JP) 2013-08-08 US disclosed
US-20130204009-A1 PROCESS FOR PREPARING BENZOIC ACID ESTERS DAIICHI SANKYO COMPANY, LIMITED (JP) 2013-08-08 US disclosed
US-20130204009-A1 PROCESS FOR PREPARING BENZOIC ACID ESTERS DAIICHI SANKYO COMPANY, LIMITED (JP) 2013-08-08 US disclosed
EP-2615081-A1 PROCESS FOR PREPARING BENZOIC ACID ESTERS DAIICHI SANKYO COMPANY, LIMITED (JP) 2013-07-17 EP disclosed
US-20130045994-A1 PYRIDINE DERIVATIVE DAIICHI SANKYO COMPANY, LIMITED (JP) 2013-02-21 US disclosed
US-20130045994-A1 PYRIDINE DERIVATIVE DAIICHI SANKYO COMPANY, LIMITED (JP) 2013-02-21 US disclosed
US-20130045994-A1 PYRIDINE DERIVATIVE DAIICHI SANKYO COMPANY, LIMITED (JP) 2013-02-21 US disclosed
US-20120029026-A1 PYRIDINE DERIVATIVE DAIICHI SANKYO COMPANY, LIMITED (JP) 2012-02-02 US disclosed
US-20120029026-A1 PYRIDINE DERIVATIVE DAIICHI SANKYO COMPANY, LIMITED (JP) 2012-02-02 US disclosed
US-20120029026-A1 PYRIDINE DERIVATIVE DAIICHI SANKYO COMPANY, LIMITED (JP) 2012-02-02 US disclosed
EP-2404918-A1 PYRIDINE DERIVATIVE Daiichi Sankyo Company, Limited (JP) 2012-01-11 EP disclosed
EP-2404918-A1 PYRIDINE DERIVATIVE Daiichi Sankyo Company, Limited (JP) 2012-01-11 EP 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 (3 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-20130204009-A1 PROCESS FOR PREPARING BENZOIC ACID ESTERS HPD, CYP2B6, PAH PPARG 323/4885
US-20120029026-A1 PYRIDINE DERIVATIVE PPARD, PPARG, PPARA PPARG 2/4885
US-20130045994-A1 PYRIDINE DERIVATIVE PPARD, PPARG, PPARA PPARG 2/4885

“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.