SCHEMBL161601

SCHEMBL161601

CCOP(=O)(CCOCCOCCI)OCC

nearest known ligand 0.47

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
PPARD Q03181 2/20 0.47
TSHR P16473 3/20 0.43
CYP3A4 P08684 1/20 0.35
TP53 P04637 1/20 0.33
TDP1 Q9NUW8 1/20 0.33
ALDH1A1 P00352 1/20 0.32

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
SCHEMBL1527539 1.00 PPARD (0.47) PPARDTSHRCYP3A4TP53TDP1
SCHEMBL4881306 0.89 PPARD (0.56) PPARDTSHRCYP3A4TP53TDP1
SCHEMBL4882046 0.89 PPARD (0.56) PPARDTSHRCYP3A4TP53TDP1
SCHEMBL23430674 0.85 PPARD (0.52) PPARDTSHRCYP3A4TP53TDP1
SCHEMBL3220479 0.83 PPARD (0.50) PPARDTSHRCYP3A4TP53TDP1
SCHEMBL14007050 0.82 PPARD (0.48) PPARDTSHRCYP3A4TP53TDP1
SCHEMBL23786286 0.81 PPARD (0.52) PPARDTSHRCYP3A4TP53TDP1
SCHEMBL4164665 0.81 PPARD (0.56) PPARDTSHRTP53TDP1ALDH1A1
SCHEMBL23962601 0.80 PPARD (0.47) PPARDTSHRCYP3A4TP53TDP1
SCHEMBL20990630 0.80 PPARD (0.63) PPARDTSHRCYP3A4TP53TDP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10098949-B2 Adsorption of immunopotentiators to insoluble metal salts GLAXOSMITHKLINE BIOLOGICALS S.A. (BE) 2018-10-16 US disclosed
US-9950062-B2 Compounds and compositions as TLR activity modulators GLAXOSMITHKLINE BIOLOGICALS SA (BE) 2018-04-24 US disclosed
EP-2473508-B1 COMPOUNDS AND COMPOSITIONS AS TLR ACTIVITY MODULATORS NOVARTIS AG (CH) 2017-03-08 EP disclosed
EP-2822947-B1 ARGININE SALTS OF A TLR7 AGONIST GLAXOSMITHKLINE BIOLOG SA (BE) 2016-08-03 EP disclosed
US-20160213776-A1 ADSORPTION OF IMMUNOPOTENTIATORS TO INSOLUBLE METAL SALTS GLAXOSMITHKLINE BIOLOGICALS SA (BE) 2016-07-28 US disclosed
US-9365506-B2 Compounds and compositions as TLR2 agonists NOVARTIS AG (CH) 2016-06-14 US disclosed
US-9320748-B2 Immunologically useful arginine salts NOVARTIS AG (CH) 2016-04-26 US disclosed
US-9320748-B2 Immunologically useful arginine salts NOVARTIS AG (CH) 2016-04-26 US disclosed
US-9315530-B2 Adsorption of immunopotentiators to insoluble metal salts NOVARTIS AG (CH) 2016-04-19 US disclosed
US-20150225432-A1 COMPOUNDS AND COMPOSITIONS AS TLR ACTIVITY MODULATORS NOVARTIS AG (CH) 2015-08-13 US disclosed
US-20120237546-A1 COMPOUNDS AND COMPOSITIONS AS TLR ACTIVITY MODULATORS NOVARTIS AG (CH) 2012-09-20 US disclosed
EP-2480253-A1 ADSORPTION OF IMMUNOPOTENTIATORS TO INSOLUBLE METAL SALTS Novartis AG (CH) 2012-08-01 EP disclosed
US-20120177681-A1 Formulation of immunopotentiators GLAXOSMITHKLINE BIOLOGICALS SA (BE) 2012-07-12 US disclosed
EP-2473508-A1 COMPOUNDS AND COMPOSITIONS AS TLR ACTIVITY MODULATORS IRM LLC (BM) 2012-07-11 EP disclosed
EP-2459216-A2 IMMUNOGENIC COMPOSITIONS INCLUDING TLR ACTIVITY MODULATORS Novartis AG (CH) 2012-06-06 EP disclosed
WO-2012031140-A1 ADSORPTION OF IMMUNOPOTENTIATORS TO INSOLUBLE METAL SALTS NOVARTIS AG (CH) 2012-03-08 WO disclosed
WO-2011119759-A1 COMPOUNDS (CYSTEIN BASED LIPOPEPTIDES) AND COMPOSITIONS AS TLR2 AGONISTS USED FOR TREATING INFECTIONS, INFLAMMATIONS, RESPIRATORY DISEASES ETC. IRM LLC (BM) 2011-09-29 WO disclosed
WO-2011049677-A1 COMPOUNDS AND COMPOSITIONS AS TLR ACTIVITY MODULATORS IRM LLC (BM) 2011-04-28 WO disclosed
WO-2011027222-A2 IMMUNOGENIC COMPOSITIONS INCLUDING TLR ACTIVITY MODULATORS NOVARTIS AG (CH) 2011-03-10 WO disclosed
US-20110053893-A1 COMPOUNDS AND COMPOSITIONS AS TLR ACTIVITY MODULATORS IRM LLC (BM) 2011-03-03 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 (6 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-20150225432-A1 COMPOUNDS AND COMPOSITIONS AS TLR ACTIVITY MODULATORS TLR1, TLR6, TLR7 PPARD 256/4885TSHR 3415/4885CYP3A4 4745/4885
US-20120237546-A1 COMPOUNDS AND COMPOSITIONS AS TLR ACTIVITY MODULATORS TLR1, TLR6, TLR7 PPARD 256/4885TSHR 3415/4885CYP3A4 4745/4885
US-20110053893-A1 COMPOUNDS AND COMPOSITIONS AS TLR ACTIVITY MODULATORS TLR1, TLR6, TLR7 PPARD 256/4885TSHR 3415/4885CYP3A4 4745/4885
US-10098949-B2 Adsorption of immunopotentiators to insoluble metal salts CD69, NFATC1, CD209 PPARD 3084/4885TSHR 3311/4885CYP3A4 3090/4885
US-20120177681-A1 Formulation of immunopotentiators CD69, CD4, ICOS PPARD 2623/4885TSHR 2960/4885CYP3A4 2345/4885
US-20160213776-A1 ADSORPTION OF IMMUNOPOTENTIATORS TO INSOLUBLE METAL SALTS CD69, CD209, CD4 PPARD 2900/4885TSHR 3024/4885CYP3A4 2670/4885

“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.