SCHEMBL619735

SCHEMBL619735

O=C(O)CC(CO)CC(=O)O

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SLC22A6 Q4U2R8 1/20 0.47
TDP1 Q9NUW8 1/20 0.45
SMN1; SMN2 Q16637 1/20 0.43
CACNA2D1 P54289 2/20 0.42
CACNB3 P54284 1/20 0.42
CACNA1C Q13936 1/20 0.42
PGR P06401 1/20 0.42
ADRA1A P35348 1/20 0.42
HTR2B P41595 1/20 0.42
CACNA2D2 Q9NY47 1/20 0.42
GABRR1 P24046 2/20 0.39
LMNA P02545 2/20 0.39
TSHR P16473 1/20 0.39
OR51E2 Q9H255 1/20 0.38
FOLH1 Q04609 1/20 0.36
CYP2D6 P10635 2/20 0.35
CYP2C19 P33261 1/20 0.35
HIF1A Q16665 1/20 0.35
MAPT P10636 1/20 0.35
LDHA P00338 1/20 0.33

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
SCHEMBL45197 0.93
SCHEMBL5905762 0.90 SLC22A6 (0.45) SLC22A6TDP1SMN1; SMN2CACNA2D1CACNB3
SCHEMBL5080081 0.90 SLC22A6 (0.45) SLC22A6TDP1SMN1; SMN2CACNA2D1CACNB3
Ammonia Solution, Strong SCHEMBL10355456 0.90 TDP1 (0.50) SLC22A6TDP1SMN1; SMN2CACNA2D1CACNB3
SCHEMBL5144811 0.90 SLC22A6 (0.45) SLC22A6TDP1SMN1; SMN2CACNA2D1CACNB3
SCHEMBL1100230 0.90 SLC22A6 (0.45) SLC22A6TDP1SMN1; SMN2CACNA2D1CACNB3
SCHEMBL5144412 0.90 SLC22A6 (0.45) SLC22A6TDP1SMN1; SMN2CACNA2D1CACNB3
SCHEMBL5905658 0.90 SLC22A6 (0.45) SLC22A6TDP1SMN1; SMN2CACNA2D1CACNB3
SCHEMBL5165804 0.90 SLC22A6 (0.45) SLC22A6TDP1SMN1; SMN2CACNA2D1CACNB3
SCHEMBL28174672 0.90 SLC22A6 (0.45) SLC22A6TDP1SMN1; SMN2CACNA2D1CACNB3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4747627-A1 METHODS AND SYSTEMS FOR PREDICTIVE CLASSIFICATION BY MASS SPECTROMETRY AND TRAINED LARGE SPECTRAL MODELS Matterworks Inc (US) 2026-05-27 EP claimed
CN-119999825-A Application of squid freeze-dried powder, feed and shrimp culturing method 海南大学 2025-05-16 CN claimed
WO-2025072741-A1 PRESERVATIVES FOR MOLECULAR SAMPLE ANALYSIS WITH SAMPLE COLLECTION DEVICES BOARD OF REGENTS, THE UNIVERSITY OF TEXAS SYSTEM (US) 2025-04-03 WO claimed
WO-2025019764-A1 METHODS AND SYSTEMS FOR PREDICTIVE CLASSIFICATION BY MASS SPECTROMETRY AND TRAINED LARGE SPECTRAL MODELS MATTERWORKS INC (US) 2025-01-23 WO claimed
EP-4437319-A1 METHODS AND COMPOSITIONS FOR ANALYTE QUANTIFICATION Matterworks Inc (US) 2024-10-02 EP claimed
CN-116381101-A Urine metabolism small molecule for assisting in diagnosing embryo planting success rate and application thereof 南京医科大学 2023-07-04 CN claimed
WO-2023077166-A1 METHODS AND COMPOSITIONS FOR ANALYTE QUANTIFICATION MATTERWORKS INC (US) 2023-05-04 WO claimed
US-20230137741-A1 METHODS AND COMPOSITIONS FOR ANALYTE QUANTIFICATION MATTERWORKS INC 2023-05-04 US claimed
WO-2017189528-A1 CORROSION INHIBITOR COMPOSITIONS AND METHODS OF USING SAME Ecolab USA, Inc. (US) 2017-11-02 WO claimed
US-20170306504-A1 CORROSION INHIBITOR COMPOSITIONS AND METHODS OF USING SAME CHAMPIONX LLC 2017-10-26 US claimed
US-8608922-B2 Biosensor for continuous monitoring of metabolites and proteins and methods of manufacture thereof THE UNIVERSITY OF CONNECTICUT (US) 2013-12-17 US claimed
US-20100116691-A1 BIOSENSOR FOR CONTINUOUS MONITORING OF METABOLITES AND PROTEINS AND METHODS OF MANUFACTURE THEREOF UNIVERSITY OF CONNECTICUT (US) 2010-05-13 US claimed
US-20090197845-A1 Method for treating olfactory disorder SAMSUNG LIFE PUBLIC WELFARE FOUNDATION SAMSUNG MEDICAL CENTER (KR) 2009-08-06 US claimed
US-20080125405-A1 Composition for treating or preventing olfactory disorder SAMSUNG LIFE PUBLIC WELFARE FOUNDATION SAMSUNG MEDICAL CENTER (KR) 2008-05-29 US claimed
US-20260148950-A1 METHODS AND SYSTEMS FOR PREDICTIVE ANALYSIS BY MASS SPECTROMETRY MATTERWORKS INC (US) 2026-05-28 US disclosed
EP-4747627-A1 METHODS AND SYSTEMS FOR PREDICTIVE CLASSIFICATION BY MASS SPECTROMETRY AND TRAINED LARGE SPECTRAL MODELS Matterworks Inc (US) 2026-05-27 EP disclosed
CN-120053660-A Hydrophilic complex for preventing, preventing or treating microbial infection, preparation and application thereof 太阳雨林(北京)生物医药有限公司 2025-05-30 CN disclosed
US-20090197845-A1 Method for treating olfactory disorder SAMSUNG LIFE PUBLIC WELFARE FOUNDATION SAMSUNG MEDICAL CENTER (KR) 2009-08-06 US disclosed
US-20090197845-A1 Method for treating olfactory disorder SAMSUNG LIFE PUBLIC WELFARE FOUNDATION SAMSUNG MEDICAL CENTER (KR) 2009-08-06 US disclosed
US-20080125405-A1 Composition for treating or preventing olfactory disorder SAMSUNG LIFE PUBLIC WELFARE FOUNDATION SAMSUNG MEDICAL CENTER (KR) 2008-05-29 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 (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-20260148950-A1 METHODS AND SYSTEMS FOR PREDICTIVE ANALYSIS BY MASS SPECTROMETRY SRMS, PTMS, CALCB SLC22A6 560/4885TDP1 4693/4885SMN1; SMN2 2945/4885

“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.