SCHEMBL1804097

SCHEMBL1804097

CC(=O)NCCS(=O)(=O)[O-].CC(=O)NCCS(=O)(=O)[O-].[Mg+2]

nearest known ligand 0.46

Known targets — ChEMBL curated mechanism

ATP4AATP4BGABBR1GABBR2HMGCR

The experimentally established mechanism targets of None. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.46
MAPK1 P28482 1/20 0.46
HIF1A Q16665 1/20 0.46
BBOX1 O75936 1/20 0.45
TSHR P16473 1/20 0.43
ALDH1A1 P00352 1/20 0.41
PAOX Q6QHF9 3/20 0.39
LOX P28300 1/20 0.38
ADRA1A P35348 1/20 0.38
EPHX2 P34913 1/20 0.36
TXNRD1 Q16881 1/20 0.35
F13A1 P00488 1/20 0.34

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
Water SCHEMBL22263593 0.98 KDM4E (0.44) KDM4EMAPK1HIF1ABBOX1TSHR
Zinc Ion SCHEMBL927086 0.95 KDM4E (0.46) KDM4EMAPK1HIF1ABBOX1TSHR
Lithium Ion SCHEMBL11350422 0.95 KDM4E (0.46) KDM4EMAPK1HIF1ABBOX1TSHR
SCHEMBL927005 0.95 KDM4E (0.46) KDM4EMAPK1HIF1ABBOX1TSHR
SCHEMBL2590649 0.95 KDM4E (0.46) KDM4EMAPK1HIF1ABBOX1TSHR
SCHEMBL31512217 0.95 KDM4E (0.46) KDM4EMAPK1HIF1ABBOX1TSHR
Water SCHEMBL31512212 0.93 KDM4E (0.44) KDM4EMAPK1HIF1ABBOX1TSHR
Water SCHEMBL31512215 0.93 KDM4E (0.44) KDM4EMAPK1HIF1ABBOX1TSHR
Water SCHEMBL31512211 0.93 KDM4E (0.44) KDM4EMAPK1HIF1ABBOX1TSHR
Water SCHEMBL31512210 0.93 KDM4E (0.44) KDM4EMAPK1HIF1ABBOX1TSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12383520-B2 Compound and composition for use in the treatment of premenstrual syndrome and/or premenstrual dysphoric disorder SYNAPHARM INDUSTRIAL SYNTHESIS (BE) 2025-08-12 US claimed
CN-119431198-A Preparation method of magnesium acetyltaurate 苏州满元生物科技有限公司 2025-02-14 CN claimed
EP-3750873-B1 METHOD FOR MANUFACTURING MAGNESIUM N-ACETYL-TAURINATE SYNAPHARM IND SYNTHESIS (BE) 2023-12-20 EP claimed
EP-4228609-A1 DIRECTLY ADMINISTERED GRANULAR COMPOSITION HAVING A COMBINATION OF DELAYED-RELEASE AND RAPID-RELEASE MAGNESIUM, AND PROCESSES FOR THE PRODUCTION THEREOF HERMES PHARMA GmbH (DE) 2023-08-23 EP claimed
WO-2023057451-A1 DIRECTLY ADMINISTERED GRANULAR COMPOSITION HAVING A COMBINATION OF DELAYED-RELEASE AND RAPID-RELEASE MAGNESIUM, AND PROCESSES FOR THE PRODUCTION THEREOF HERMES PHARMA GMBH (DE) 2023-04-13 WO claimed
US-20220218633-A1 COMPOUND AND COMPOSITION FOR USE IN THE TREATMENT OF PREMENSTRUAL SYNDROME AND/OR PREMENSTRUAL DYSPHORIC DISORDER SYNAPHARM INDUSTRIAL SYNTHESIS (BE) 2022-07-14 US claimed
EP-3738596-B1 COMPOUND AND COMPOSITION FOR USE IN THE TREATMENT OF PREMENSTRUAL SYNDROME AND/OR PREMENSTRUAL DYSPHORIC DISORDER SYNAPHARM IND SYNTHESIS (BE) 2022-03-16 EP claimed
WO-2020229443-A1 COMPOUND AND COMPOSITION FOR USE IN THE TREATMENT OF PREMENSTRUAL SYNDROME AND/OR PREMENSTRUAL DYSPHORIC DISORDER SYNAPHARM INDUSTRIAL SYNTHESIS (BE) 2020-11-19 WO claimed
EP-3694505-A1 COMPOUND AND COMPOSITION FOR USE IN THE PREVENTIVE AND/OR CURATIVE TREATMENT OF DISEASES OF THE CENTRAL NERVOUS SYSTEM CHARACTERISED BY A DECLINE IN NEURONAL PLASTICITY, IN PARTICULAR CHARACTERISED BY A DECLINE IN SYNAPTIC PLASTICITY Synapharm Industrial Synthesis (BE) 2020-08-19 EP claimed
EP-4228609-B1 DIRECT GRANULES WITH A COMBINATION OF RETARDED AND FAST-RELEASING MAGNESIUM HERMES PHARMA GMBH (DE) 2026-04-29 EP disclosed
WO-2026018281-A1 A SYNERGISTIC COMPOSITION FOR THE TREATMENT OF DISORDERS RELATED TO CENTRAL NERVOUS SYSTEM (CNS) EXCITABILITY. Celagenex Research (India) Pvt. Ltd. (IN) 2026-01-22 WO disclosed
US-12383520-B2 Compound and composition for use in the treatment of premenstrual syndrome and/or premenstrual dysphoric disorder SYNAPHARM INDUSTRIAL SYNTHESIS (BE) 2025-08-12 US disclosed
CN-119431198-A Preparation method of magnesium acetyltaurate 苏州满元生物科技有限公司 2025-02-14 CN disclosed
CN-119431198-A Preparation method of magnesium acetyltaurate 苏州满元生物科技有限公司 2025-02-14 CN disclosed
WO-2019072568-A1 COMPOUND AND COMPOSITION FOR USE IN THE PREVENTIVE AND/OR CURATIVE TREATMENT OF DISEASES OF THE CENTRAL NERVOUS SYSTEM CHARACTERISED BY A DECLINE IN NEURONAL PLASTICITY, IN PARTICULAR CHARACTERISED BY A DECLINE IN SYNAPTIC PLASTICITY SYNAPHARM INDUSTRIAL SYNTHESIS (BE) 2019-04-18 WO disclosed
WO-2019072568-A1 COMPOUND AND COMPOSITION FOR USE IN THE PREVENTIVE AND/OR CURATIVE TREATMENT OF DISEASES OF THE CENTRAL NERVOUS SYSTEM CHARACTERISED BY A DECLINE IN NEURONAL PLASTICITY, IN PARTICULAR CHARACTERISED BY A DECLINE IN SYNAPTIC PLASTICITY SYNAPHARM INDUSTRIAL SYNTHESIS (BE) 2019-04-18 WO disclosed
EP-2324832-B2 Nutritional supplement while taking hormonal contraceptives BIOGENA NATURPRODUKTE GMBH & CO KG (AT) 2016-11-30 EP disclosed
EP-2324832-B1 Nutritional supplement while taking hormonal contraceptives BIOGENA NATURPRODUKTE GMBH & CO KG (AT) 2014-05-14 EP disclosed
EP-2324832-A1 Nutritional supplement while taking hormonal contraceptives Biogena Naturprodukte GmbH & Co KG (AT) 2011-05-25 EP disclosed
US-4267194-A Calcium derivatives of taurine having reinforced neuro-muscular activity LES LABORATORIES MERAM (FR) 1981-05-12 US disclosed