SCHEMBL13876110

SCHEMBL13876110

O=C(O)COC(=O)COC(=O)CO

nearest known ligand 0.48

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
PAM P19021 3/20 0.48
TSHR P16473 1/20 0.38
CTH P32929 1/20 0.38
CBS P35520 1/20 0.38
THPO P40225 1/20 0.38
THRB P10828 1/20 0.36
ALOX15 P16050 1/20 0.30

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
SCHEMBL15282749 1.00 PAM (0.48) PAMTSHRCTHCBSTHPO
SCHEMBL184262 0.95
SCHEMBL1560067 0.92 PAM (0.50) PAMTSHRCTHCBSTHPO
SCHEMBL5317672 0.92 PAM (0.50) PAMTSHRCTHCBSTHPO
SCHEMBL13144599 0.83 PAM (0.32) PAM
SCHEMBL15260571 0.81 ADRA2A (0.37) PAMTSHR
SCHEMBL12860828 0.81 ADRA2A (0.37) PAMTSHR
SCHEMBL15282788 0.81 ADRA2A (0.37) PAMTSHR
SCHEMBL17644472 0.79 PAM (0.30) PAM
Glycolic Acid SCHEMBL28515328 0.78 PAM (0.44) PAMTSHRCTHCBSTHPO

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4049992-A1 PROCESS FOR PRODUCING MONOCHLOROACETIC ACID FROM GLYCOLIC ACID Nouryon Chemicals BV (NL) 2022-08-31 EP disclosed
EP-2858971-B1 HYDROCARBOXYLATION OF AQUEOUS FORMALDEHYDE USING A DEHYDRATING RECYCLE STREAM TO DECREASE WATER CONCENTRATION EASTMAN CHEM CO (US) 2016-04-06 EP disclosed
EP-2858971-B1 HYDROCARBOXYLATION OF AQUEOUS FORMALDEHYDE USING A DEHYDRATING RECYCLE STREAM TO DECREASE WATER CONCENTRATION EASTMAN CHEM CO (US) 2016-04-06 EP disclosed
US-9180229-B2 Antimicrobial polymer compositions and the use thereof ETHICON, INC. (US) 2015-11-10 US disclosed
US-9114328-B2 Reactive distillation of a carboxylic acid and a glycol EASTMAN CHEMICAL COMPANY (US) 2015-08-25 US disclosed
US-9114328-B2 Reactive distillation of a carboxylic acid and a glycol EASTMAN CHEMICAL COMPANY (US) 2015-08-25 US disclosed
US-9114328-B2 Reactive distillation of a carboxylic acid and a glycol EASTMAN CHEMICAL COMPANY (US) 2015-08-25 US disclosed
US-9040748-B2 Hydrocarboxylation of aqueous formaldehyde using a dehydrating recycle stream to decrease water concentration EASTMAN CHEMICAL COMPANY (US) 2015-05-26 US disclosed
US-9040748-B2 Hydrocarboxylation of aqueous formaldehyde using a dehydrating recycle stream to decrease water concentration EASTMAN CHEMICAL COMPANY (US) 2015-05-26 US disclosed
US-9040748-B2 Hydrocarboxylation of aqueous formaldehyde using a dehydrating recycle stream to decrease water concentration EASTMAN CHEMICAL COMPANY (US) 2015-05-26 US disclosed
US-20130261329-A1 HYDROCARBOXYLATION OF METHYLENE DIPROPIONATE IN THE PRESENCE OF A PROPIONIC ACID AND A HOMOGENEOUS CATALYST EASTMAN CHEMICAL COMPANY (US) 2013-10-03 US disclosed
US-20130261333-A1 HYDROCARBOXYLATION OF FORMALDEHYDE IN THE PRESENCE OF A HIGHER ORDER CARBOXYLIC ACID AND HETEROGENEOUS CATALYST EASTMAN CHEMICAL COMPANY (US) 2013-10-03 US disclosed
US-20130261329-A1 HYDROCARBOXYLATION OF METHYLENE DIPROPIONATE IN THE PRESENCE OF A PROPIONIC ACID AND A HOMOGENEOUS CATALYST EASTMAN CHEMICAL COMPANY (US) 2013-10-03 US disclosed
US-20130261329-A1 HYDROCARBOXYLATION OF METHYLENE DIPROPIONATE IN THE PRESENCE OF A PROPIONIC ACID AND A HOMOGENEOUS CATALYST EASTMAN CHEMICAL COMPANY (US) 2013-10-03 US disclosed
US-20130261328-A1 HYDROCARBOXYLATION OF FORMALDEHYDE IN THE PRESENCE OF A HIGHER ORDER CARBOXYLIC ACID AND A HOMOGENEOUS CATALYST EASTMAN CHEMICAL COMPANY (US) 2013-10-03 US disclosed
US-20130261328-A1 HYDROCARBOXYLATION OF FORMALDEHYDE IN THE PRESENCE OF A HIGHER ORDER CARBOXYLIC ACID AND A HOMOGENEOUS CATALYST EASTMAN CHEMICAL COMPANY (US) 2013-10-03 US disclosed
WO-2013142091-A1 PASSIVATION OF A HOMEGENEOUS HYDROGENATION CATALYST FOR THE PRODUCTION OF ETHYLENE GLYCOL EASTMAN CHEMICAL COMPANY (US) 2013-09-26 WO disclosed
US-20130253230-A1 PASSIVATION OF A HOMOGENEOUS HYDROGENATION CATALYST FOR THE PRODUCTION OF ETHYLENE GLYCOL EASTMAN CHEMICAL COMPANY (US) 2013-09-26 US disclosed
WO-2013014454-A1 NEW (TRIMETHOXYPHENYLAMINO)PYRIMIDINYL FORMULATIONS ASTRAZENECA AB (SE) 2013-01-31 WO disclosed
US-20090092648-A1 ANTIMICROBIAL POLYMER COMPOSITIONS AND THE USE THEREOF ETHICON, INC. (US) 2009-04-09 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 (5 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-20130261328-A1 HYDROCARBOXYLATION OF FORMALDEHYDE IN THE PRESENCE OF A HIGHER ORDER CARBOXYLIC ACID AND A HOMOGENEOUS CATALYST GRHPR, HAO2, HPD PAM 1079/4885TSHR 2483/4885CTH 640/4885
US-20130261333-A1 HYDROCARBOXYLATION OF FORMALDEHYDE IN THE PRESENCE OF A HIGHER ORDER CARBOXYLIC ACID AND HETEROGENEOUS CATALYST GRHPR, HAO2, GCDH PAM 1331/4885TSHR 2497/4885CTH 508/4885
US-20130261329-A1 HYDROCARBOXYLATION OF METHYLENE DIPROPIONATE IN THE PRESENCE OF A PROPIONIC ACID AND A HOMOGENEOUS CATALYST GRHPR, HPD, PGD PAM 137/4885TSHR 2515/4885CTH 199/4885
US-20130253230-A1 PASSIVATION OF A HOMOGENEOUS HYDROGENATION CATALYST FOR THE PRODUCTION OF ETHYLENE GLYCOL HPD, TALDO1, GRHPR PAM 63/4885TSHR 629/4885CTH 600/4885
US-20090092648-A1 ANTIMICROBIAL POLYMER COMPOSITIONS AND THE USE THEREOF PAM, ARG1, HRH3 PAM 1/4885TSHR 538/4885CTH 1039/4885

“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.