SCHEMBL4619019

SCHEMBL4619019

[Ba+2].[Ca+2].[O-2].[O-2]

nearest known ligand 0.00

Known targets — ChEMBL curated mechanism

GABBR1GABBR2GABRA1GABRA2GABRA3GABRA4GABRA5GABRA6GABRB1GABRB2GABRB3GABRDGABREGABRG1GABRG2GABRG3GABRPGABRQGRIN1GRIN2AGRIN2BGRIN2CGRIN2DGRIN3AGRIN3BHMGCRMMP1MMP13MMP7MMP8PTGS1PTGS2ileSpolrplArplBrplCrplDrplErplFrplJrplKrplLrplMrplNrplOrplPrplQrplRrplSrplTrplUrplVrplWrplXrplYrpmArpmBrpmCrpmDrpmErpmFrpmGrpmHrpmIrpmJrpsArpsBrpsCrpsDrpsErpsFrpsGrpsHrpsIrpsJrpsKrpsLrpsMrpsNrpsOrpsPrpsQrpsRrpsSrpsTrpsUykgMykgO

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
SCHEMBL6032707 0.87
SCHEMBL29433927 0.87
SCHEMBL30087487 0.87
SCHEMBL73924 0.87
SCHEMBL6010002 0.87
Zinc Ion SCHEMBL31357183 0.87
SCHEMBL28737 0.82
SCHEMBL12486891 0.82
SCHEMBL10576947 0.82
SCHEMBL8047724 0.82

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240082825-A1 METAL-DECORATED BARIUM CALCIUM ALUMINUM OXIDE AND RELATED MATERIALS FOR NH3 CATALYSIS STARFIRE ENERGY 2024-03-14 US claimed
CN-117142476-A Method for removing metal and nonmetal impurities in industrial silicon by external refining 四川纳毕硅基材料科技有限公司 2023-12-01 CN claimed
US-11772071-B2 Metal-decorated barium calcium aluminum oxide and related materials for NH3 catalysis STARFIRE ENERGY (US) 2023-10-03 US claimed
US-20220331780-A1 METAL-DECORATED BARIUM CALCIUM ALUMINUM OXIDE AND RELATED MATERIALS FOR NH3 CATALYSIS STARFIRE ENERGY 2022-10-20 US claimed
US-20080207426-A1 Heat Insulating Composite and Methods of Manufacturing Thereof ADVANCED GLASS CERAMICS ESTABLISHMENT (LI) 2008-08-28 US claimed
WO-2008043373-A1 HEAT INSULATING COMPOSITE AND METHODS OF MANUFACTURING THEREOF ADVANCED GLASS CERAMICS ESTABLISHMENT (LI) 2008-04-17 WO claimed
EP-1890981-A1 HEAT INSULATING COMPOSITE AND METHODS OF MANUFACTURING THEREOF Advanced Glass Ceramics Establishment (LI) 2008-02-27 EP claimed
WO-2006128672-A1 HEAT INSULATING COMPOSITE AND METHODS OF MANUFACTURING THEREOF ADVANCED GLASS CERAMICS ESTABLISHMENT (LI) 2006-12-07 WO claimed
US-20260042751-A1 AROMATIC HETEROCYCLIC DERIVATIVE, MATERIAL FOR ORGANIC ELECTROLUMINESCENT ELEMENT, AND ORGANIC ELECTROLUMINESCENT ELEMENT IDEMITSU KOSAN CO.,LTD. (JP) 2026-02-12 US disclosed
US-12516042-B2 Aromatic heterocyclic derivative, material for organic electroluminescent element, and organic electroluminescent element IDEMITSU KOSAN CO., LTD. (JP) 2026-01-06 US disclosed
CN-116143716-B Novel compound, material for organic electroluminescent element, and organic electroluminescent element 出光兴产株式会社 2025-03-28 CN disclosed
US-20250040433-A1 AROMATIC HETEROCYCLIC DERIVATIVE, MATERIAL FOR ORGANIC ELECTROLUMINESCENT ELEMENT, AND ORGANIC ELECTROLUMINESCENT ELEMENT IDEMITSU KOSAN CO.,LTD. (JP) 2025-01-30 US disclosed
US-20250008837-A1 AROMATIC HETEROCYCLIC DERIVATIVE, MATERIAL FOR ORGANIC ELECTROLUMINESCENT ELEMENT, AND ORGANIC ELECTROLUMINESCENT ELEMENT IDEMITSU KOSAN CO.,LTD. (JP) 2025-01-02 US disclosed
US-12089492-B2 Aromatic heterocyclic derivative, material for organic electroluminescent element, and organic electroluminescent element IDEMITSU KOSAN CO., LTD. (JP) 2024-09-10 US disclosed
US-20130214258-A1 CARBAZOLE COMPOUND, MATERIAL FOR ORGANIC ELECTROLUMINESCENCE DEVICE AND ORGANIC ELECTROLUMINESCENCE DEVICE IDEMITSU KOSAN CO., LTD. (JP) 2013-08-22 US disclosed
US-20080207426-A1 Heat Insulating Composite and Methods of Manufacturing Thereof ADVANCED GLASS CERAMICS ESTABLISHMENT (LI) 2008-08-28 US disclosed
WO-2008043373-A1 HEAT INSULATING COMPOSITE AND METHODS OF MANUFACTURING THEREOF ADVANCED GLASS CERAMICS ESTABLISHMENT (LI) 2008-04-17 WO disclosed
EP-1890981-A1 HEAT INSULATING COMPOSITE AND METHODS OF MANUFACTURING THEREOF Advanced Glass Ceramics Establishment (LI) 2008-02-27 EP disclosed
WO-2006128672-A1 HEAT INSULATING COMPOSITE AND METHODS OF MANUFACTURING THEREOF ADVANCED GLASS CERAMICS ESTABLISHMENT (LI) 2006-12-07 WO disclosed
CN-1134314-A Solid basic catalyst, process for producing the same and process for producing carbonyl compound derivative using the same CHISSO CORP (JP) 1996-10-30 CN disclosed