SCHEMBL14879765

SCHEMBL14879765

O=C(O)Cc1ccc(C(=O)O)c(O)c1

nearest known ligand 0.68

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GAA P10253 4/20 0.68
MAPT P10636 4/20 0.68
KDM4E B2RXH2 4/20 0.68
TSHR P16473 3/20 0.68
HPGD P15428 3/20 0.68
HSD17B10 Q99714 3/20 0.68
NFKB1 P19838 2/20 0.68
TDP1 Q9NUW8 2/20 0.68
POLB P06746 2/20 0.68
RGS12 O14924 1/20 0.68
LMNA P02545 1/20 0.68
APEX1 P27695 1/20 0.68
THPO P40225 1/20 0.68
BLM P54132 1/20 0.68
GNAI1 P63096 1/20 0.68
PMP22 Q01453 1/20 0.68
HIF1A Q16665 1/20 0.68
CA2 P00918 3/20 0.56
PPARA Q07869 1/20 0.56
ALDH1A1 P00352 5/20 0.55

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
SCHEMBL28115877 0.85 PPARA (0.57) GAAMAPTKDM4ETSHRHPGD
SCHEMBL11108409 0.85 HPGD (0.63) GAAMAPTKDM4ETSHRHPGD
SCHEMBL13209792 0.85 ALDH1A1 (0.53) GAAMAPTKDM4ETSHRHPGD
SCHEMBL28208328 0.84 KLKB1 (0.71) GAAMAPTKDM4ETSHRHPGD
SCHEMBL7562901 0.83 KDM4E (0.55) GAAMAPTKDM4ETSHRHPGD
SCHEMBL9470534 0.83 ALDH1A1 (0.52) GAAMAPTKDM4ETSHRHPGD
SCHEMBL1401513 0.82 ALDH1A1 (0.57) GAAMAPTKDM4ETSHRHPGD
SCHEMBL2837159 0.82 ALDH1A1 (0.57) GAAMAPTKDM4ETSHRHPGD
3,4-Dihydroxyphenylacetic Acid SCHEMBL29382155 0.81 GAA (1.00) GAAMAPTKDM4ETSHRHPGD
3,4-Dihydroxyphenylacetic Acid SCHEMBL36348 0.81 GAA (1.00) GAAMAPTKDM4ETSHRHPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-103880679-B Synthesis method of 3- ethyoxyl-4-ethoxycarbonyl phenylacetic acid UNIV HEBEI SCIENCE & TECH 2015-02-11 CN claimed
CN-103880679-A Synthesis method of 3- ethyoxyl-4-ethoxycarbonyl phenylacetic acid UNIV HEBEI SCIENCE & TECH 2014-06-25 CN claimed
US-11970448-B2 Monomers capable of dimerizing in an aqueous solution, and methods of using same CORNELL UNIVERSITY (US) 2024-04-30 US disclosed
US-20200354319-A1 MONOMERS CAPABLE OF DIMERIZING IN AN AQUEOUS SOLUTION, AND METHODS OF USING SAME UNIV CORNELL (US) 2020-11-12 US disclosed
US-20200354319-A1 MONOMERS CAPABLE OF DIMERIZING IN AN AQUEOUS SOLUTION, AND METHODS OF USING SAME UNIV CORNELL (US) 2020-11-12 US disclosed
CN-106397787-B three-dimensional manganese coordination polymer structure containing dicarboxylic acid ligand and preparation method thereof 齐鲁工业大学 2020-01-31 CN disclosed
CN-103880679-B Synthesis method of 3- ethyoxyl-4-ethoxycarbonyl phenylacetic acid UNIV HEBEI SCIENCE & TECH 2015-02-11 CN disclosed
US-20140194383-A1 MONOMERS CAPABLE OF DIMERIZING IN AN AQUEOUS SOLUTION, AND METHODS OF USING SAME CORNELL UNIVERSITY (US) 2014-07-10 US disclosed
US-20140194383-A1 MONOMERS CAPABLE OF DIMERIZING IN AN AQUEOUS SOLUTION, AND METHODS OF USING SAME CORNELL UNIVERSITY (US) 2014-07-10 US disclosed
CN-103880679-A Synthesis method of 3- ethyoxyl-4-ethoxycarbonyl phenylacetic acid UNIV HEBEI SCIENCE & TECH 2014-06-25 CN disclosed
EP-2694707-A1 MONOMERS CAPABLE OF DIMERIZING IN AN AQUEOUS SOLUTION, AND METHODS OF USING SAME Cornell University (US) 2014-02-12 EP disclosed
WO-2013058824-A1 MONOMERS CAPABLE OF DIMERIZING IN AN AQUEOUS SOLUTION, AND METHODS OF USING SAME CORNELL UNIVERSITY (US) 2013-04-25 WO disclosed
WO-2013058824-A1 MONOMERS CAPABLE OF DIMERIZING IN AN AQUEOUS SOLUTION, AND METHODS OF USING SAME CORNELL UNIVERSITY (US) 2013-04-25 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 (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-11970448-B2 Monomers capable of dimerizing in an aqueous solution, and methods of using same CALCOCO2, MDN1, MBNL1 GAA 4698/4885MAPT 1617/4885KDM4E 4611/4885
US-20200354319-A1 MONOMERS CAPABLE OF DIMERIZING IN AN AQUEOUS SOLUTION, AND METHODS OF USING SAME CALCOCO2, MDN1, MBNL1 GAA 4698/4885MAPT 1617/4885KDM4E 4611/4885
US-20140194383-A1 MONOMERS CAPABLE OF DIMERIZING IN AN AQUEOUS SOLUTION, AND METHODS OF USING SAME CALCOCO2, MDN1, MBNL1 GAA 4698/4885MAPT 1617/4885KDM4E 4611/4885

“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.