SCHEMBL1157071

SCHEMBL1157071

O=C(O[C@@H]1CO[C@H]2[C@@H]1OC[C@@H]2O)c1ccccc1

nearest known ligand 0.68

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
BCHE P06276 19/20 0.68
CES2 O00748 1/20 0.45

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
SCHEMBL18631354 1.00 BCHE (0.68) BCHECES2
SCHEMBL4382472 1.00 BCHE (0.68) BCHECES2
SCHEMBL18631352 1.00 BCHE (0.68) BCHECES2
SCHEMBL5475188 1.00 BCHE (0.68) BCHECES2
SCHEMBL13574473 1.00 BCHE (0.68) BCHECES2
SCHEMBL19178469 0.92 BCHE (0.57) BCHE
SCHEMBL7145226 0.92 BCHE (0.78) BCHECES2
SCHEMBL4570654 0.92 BCHE (0.78) BCHECES2
SCHEMBL21574420 0.92 BCHE (0.78) BCHECES2
SCHEMBL15845097 0.92 BCHE (0.78) BCHECES2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2222681-B1 EFFICIENT ASPIRIN PRODRUGS PROVOST FELLOWS & SCHOLARS COLLEGE OF THE HOLY UNDIVIDED TRINITY OF QUEEN ELIZABETH NEAR DUBLIN (IE) 2016-02-17 EP disclosed
US-8486974-B2 Efficient aspirin prodrugs THE PROVOST, FELLOWS AND SCHOLARS OF THE COLLEGE OF THE HOLY AND UNDIVIDED TRINITY OF QUEEN ELIZABETH (IE) 2013-07-16 US disclosed
US-20110046182-A1 EFFICIENT ASPIRIN PRODRUGS THE PROVOST, FELLOWS AND SCHOLARS OF THE COLLEGE OF THE HOLY AND UNDIVIDED TRINITY OF QUEEN ELIZABE (IE) 2011-02-24 US disclosed
EP-2222681-A1 EFFICIENT ASPIRIN PRODRUGS The Provost, Fellows And Scholars Of The College Of The Holy And Undivided Trinity Of Queen Elizabeth (IE) 2010-09-01 EP disclosed
WO-2009080795-A1 EFFICIENT ASPIRIN PRODRUGS THE PROVOST, FELLOWS AND SCHOLARS OF THE COLLEGE OF THE HOLY AND UNDIVIDED TRINITY OF QUEEN ELIZABETH, NEAR DUBLIN (IE) 2009-07-02 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-20110046182-A1 EFFICIENT ASPIRIN PRODRUGS COX15, PTGS1, CYP3A43 BCHE 1941/4885CES2 1385/4885

“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.