SCHEMBL3447331

SCHEMBL3447331

CCOOC(=O)CC(=O)O

nearest known ligand 0.40

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
MGAM O43451 1/20 0.40
GAA P10253 1/20 0.40
SI P14410 1/20 0.40
MGAM2 Q2M2H8 1/20 0.40
LDHA P00338 1/20 0.38
SRR Q9GZT4 1/20 0.38
FFAR3 O14843 2/20 0.36
TSHR P16473 3/20 0.34
EGLN1 Q9GZT9 1/20 0.34
ALDH1A1 P00352 6/20 0.32
CYP2D6 P10635 2/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
TRPA1 O75762 1/20 0.32
HDAC3 O15379 1/20 0.32
HDAC1 Q13547 1/20 0.32
HDAC2 Q92769 1/20 0.32
HDAC8 Q9BY41 1/20 0.32
LMNA P02545 1/20 0.31
HSD17B10 Q99714 1/20 0.31

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
SCHEMBL15949952 0.98 MGAM (0.39) MGAMGAASIMGAM2LDHA
Butane SCHEMBL7432054 0.93 MGAM (0.36) MGAMGAASIMGAM2LDHA
SCHEMBL3448001 0.81 LDHA (0.35) MGAMGAASIMGAM2LDHA
SCHEMBL3841890 0.81 GAA (0.48) MGAMGAASIMGAM2TSHR
SCHEMBL13719657 0.80 MGAM (0.52) MGAMGAASIMGAM2TSHR
SCHEMBL29746871 0.79 PTGS1 (0.38) MGAMGAASIMGAM2FFAR3
SCHEMBL23832219 0.78 GAA (0.71) MGAMGAASIMGAM2TSHR
SCHEMBL11805895 0.78 MGAM (0.44) MGAMGAASIMGAM2TSHR
SCHEMBL3447386 0.78 EGLN1 (0.46) FFAR3TSHREGLN1ALDH1A1HDAC3
SCHEMBL26127843 0.78 TDP1 (0.41) MGAMGAASIMGAM2TSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-1693300-A Process for environmental protecting cleaning producing high pure methoxy (ethoxy) methylene (ethylene) malonic ester LI KUANYI (CN) 2005-11-09 CN claimed
EP-2731431-B1 ENHANCED ANTIMICROBIAL PERACID COMPOSITIONS AND METHODS OF USE AT REDUCED TEMPERATURES IN ASEPTIC CLEANING ECOLAB USA INC (US) 2019-08-21 EP disclosed
US-10240447-B2 Method for optimizing conductivity in a hydraulic fracturing operation BAKER HUGHES, A GE COMPANY, LLC (US) 2019-03-26 US disclosed
US-10138418-B2 Hydraulic fracturing composition, method for making and use of same BAKER HUGHES, A GE COMPANY, LLC (US) 2018-11-27 US disclosed
US-20180044579-A1 HYDRAULIC FRACTURING COMPOSITION, METHOD FOR MAKING AND USE OF SAME BAKER HUGHES, A GE COMPANY, LLC (US) 2018-02-15 US disclosed
US-9828844-B2 Hydraulic fracturing composition, method for making and use of same BAKER HUGHTES, a GE company, LLC (US) 2017-11-28 US disclosed
US-9809742-B2 Hydraulic fracturing composition, method for making and use of same BAKER HUGHES, A GE COMPANY, LLC (US) 2017-11-07 US disclosed
US-9802846-B2 Treating and recylcing oilfield waste water BAKER HUGHES, A GE COMPANY, LLC (US) 2017-10-31 US disclosed
EP-3234062-A1 COMPOSITIONS AND METHODS OF IMPROVING HYDRAULIC FRACTURE NETWORK Baker Hughes Incorporated (US) 2017-10-25 EP disclosed
EP-3234060-A1 HYDRAULIC FRACTURING COMPOSITION, METHOD FOR MAKING AND USE OF SAME Baker Hughes Incorporated (US) 2017-10-25 EP disclosed
US-20030087786-A1 High concentration monoester peroxy dicarboxylic acid compositions, use solutions, and methods employing them ECOLAB USA INC. 2003-05-08 US disclosed
US-20030070692-A1 Peroxygen compositions and methods for carpet or upholstery cleaning or sanitizing ECOLAB USA INC. 2003-04-17 US disclosed
US-20030021853-A1 In situ mono-or diester dicarboxylate compositions ECOLAB USA INC. 2003-01-30 US disclosed
WO-2003005817-A2 HIGH CONCENTRATION MONOESTER PEROXY DICARBOXYLIC ACID COMPOSITIONS, USE SOLUTIONS, AND METHODS EMPLOYING THEM ECOLAB INC. (US) 2003-01-23 WO disclosed
WO-2003005818-A1 IN SITUMONO-OR DIESTER DICARBOXYLATE COMPOSITIONS ECOLAB INC. (US) 2003-01-23 WO disclosed
US-20020192340-A1 Method and system for reducing microbial burden on a food product ECOLAB USA INC. 2002-12-19 US disclosed
US-20020168422-A1 Two solvent antimicrobial compositions and methods employing them ECOLAB USA INC. 2002-11-14 US disclosed
WO-2002088076-A2 STABILIZED ESTER PEROXYCARBOXYLIC ACID COMPOSITIONS ECOLAB INC. (US) 2002-11-07 WO disclosed
US-20020128312-A1 Adding a C2 or higher alcohol as a stabilizer ECOLAB USA INC. 2002-09-12 US disclosed
WO-2002060280-A2 METHOD AND SYSTEM FOR REDUCING MICROBIAL BURDEN ON A FOOD PRODUCT BY APPLICATION OF ANTIMICROBIAL AGENT AND IRRADIATION TO THE FOOD PRODUCT ECOLAB INC. (US) 2002-08-08 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-20020128312-A1 Adding a C2 or higher alcohol as a stabilizer ADH1C, ADH1A, PCCA MGAM 2101/4885GAA 4299/4885SI 4047/4885
US-20030021853-A1 In situ mono-or diester dicarboxylate compositions DDC, HCAR3, ACMSD MGAM 150/4885GAA 1219/4885SI 25/4885
US-20020168422-A1 Two solvent antimicrobial compositions and methods employing them TAS2R50, HDHD5, CEL MGAM 36/4885GAA 2342/4885SI 352/4885

“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.