SCHEMBL5776356

SCHEMBL5776356

O=C([O-])OC(=O)[O-].[Mg+2]

nearest known ligand 0.00

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.

⚠ Novel chemotype — no close known analogue (best Tanimoto < 0.3). Unexplored chemical space relative to ChEMBL.

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 SCHEMBL28754926 0.96
SCHEMBL15064728 0.96 CA1 (0.33)
SCHEMBL10459297 0.91
SCHEMBL526233 0.91
SCHEMBL2214402 0.91
Potassium Ion SCHEMBL1124622 0.91
SCHEMBL6294539 0.91 CA4 (0.36)
SCHEMBL6541926 0.91 CA4 (0.36)
SCHEMBL4359131 0.91 CA4 (0.36)
SCHEMBL138247 0.91 CA4 (0.36)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-1228377-C Fireretardant thermoplastic resin composition AJINOMOTO KK (JP) 2005-11-23 CN claimed
CN-1312325-A Fireretardant thermoplastic resin composition AJINOMOTO KK (JP) 2001-09-12 CN claimed
CN-1315895-C Method for producing silicone-treated polymers WACKER POLYMER SYSTEMS GMBH (DE) 2007-05-16 CN disclosed
EP-0858336-B1 METHOD AND PHARMACEUTICAL COMPOSITION FOR REGULATING LIPID CONCENTRATION WARNER LAMBERT CO (US) 2006-12-20 EP disclosed
CN-1742030-A Method for producing silicone-treated polymers WACKER POLYMER SYSTEMS GMBH (DE) 2006-03-01 CN disclosed
CN-1735677-A Removing impurity in hydrocarbon fluid SAINT GOBAIN CERAMICS (US) 2006-02-15 CN disclosed
EP-1203767-B1 Heterocyclic-substituted alkylamide acat inhibitors WARNER LAMBERT CO (US) 2006-01-04 EP disclosed
CN-1228377-C Fireretardant thermoplastic resin composition AJINOMOTO KK (JP) 2005-11-23 CN disclosed
US-20050234124-A1 Carboxyalkylether-ACAT inhibitor combinations AUERBACH BRUCE J 2005-10-20 US disclosed
US-20040072903-A1 Carboxyalkylether-acat inhibitors combinations AUERBACH BRUCE JEFFREY (US) 2004-04-15 US disclosed
EP-0592439-B1 AMINOSULFONYL CARBAMATES WARNER LAMBERT CO (US) 2003-07-30 EP disclosed
WO-1992007826-A1 OXYSULFONYL CARBAMATES WARNER-LAMBERT COMPANY (US) 1992-05-14 WO disclosed
US-5106873-A ACAT inhibitors WARNER-LAMBERT COMPANY (US) 1992-04-21 US disclosed
US-5073565-A Atherosclerosis, anticholesterol WARNER-LAMBERT COMPANY (US) 1991-12-17 US disclosed
WO-1991017150-A1 TETRAZOLE UREA AND THIOUREA ACAT INHIBITORS WARNER-LAMBERT COMPANY (US) 1991-11-14 WO disclosed
EP-0433662-A2 Acat inhibitors WARNER-LAMBERT COMPANY (US) 1991-06-26 EP disclosed
EP-0432442-A1 ACAT inhibitors WARNER-LAMBERT COMPANY (US) 1991-06-19 EP disclosed
US-4904457-A REACTING HEAT-ACTIVATED MAGNESIUM OXIDE WITH AQUEOUS ALKALINE SOLUTION CONTAINING ALUMINATE, CARBONATE, HYDROXIDE IONS ALUMINUM COMPANY OF AMERICA (US) 1990-02-27 US disclosed
US-4752397-A Process for removing heavy metal ions from solutions using adsorbents containing activated hydrotalcite ALUMINUM COMPANY OF AMERICA (US) 1988-06-21 US disclosed
US-4656156-A ACTIVATED HYDROTALCITE AND ALUMINA CATALYST SUPPORTS ALUMINUM COMPANY OF AMERICA (US) 1987-04-07 US disclosed