SCHEMBL506090

SCHEMBL506090

[AlH3].[Ca+2].[HH]

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
SCHEMBL30468735 0.82
SCHEMBL28871709 0.82
SCHEMBL7994735 0.82
SCHEMBL724823 0.82
SCHEMBL11969923 0.82
SCHEMBL43333 0.82
SCHEMBL716266 0.82
SCHEMBL17939893 0.82
SCHEMBL184680 0.82
SCHEMBL2465867 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 383 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3736315-A1 EXOTHERMIC REACTION COMPOSITIONS University Of South Florida (US) 2020-11-11 EP claimed
US-10297848-B1 Method of controlling rate of hydrogen release from metastable hydrogen carriers HRL LABORATORIES, LLC (US) 2019-05-21 US claimed
US-9976068-B2 Method of modulated exothermic chemical systems through phase change materials UNIVERSITY OF SOUTH FLORIDA (US) 2018-05-22 US claimed
US-9899231-B2 Hard mask composition for spin-coating SAMSUNG ELECTRONICS CO., LTD. (KR) 2018-02-20 US claimed
US-20160340566-A1 METHOD OF MODULATED EXOTHERMIC CHEMICAL SYSTEMS THROUGH PHASE CHANGE MATERIALS UNIVERSITY OF SOUTH FLORIDA (US) 2016-11-24 US claimed
US-9481821-B2 Method of modulated exothermic chemical systems through phase change materials UNIVERSITY OF SOUTH FLORIDA (US) 2016-11-01 US claimed
EP-2098530-B1 Preparation method of organic-transition metal hydride complexes and their use as hydrogen storage materials HANWHA CHEMICAL CORP (KR) 2015-05-06 EP claimed
US-8863737-B2 Sustained modulation of temperature of self heating chemical system UNIVERSITY OF SOUTH FLORIDA (US) 2014-10-21 US claimed
CN-101525345-B Preparation method of organic-transition metal hydride used as hydrogen storage materials HANWHA CHEMICAL CORP 2013-11-27 CN claimed
US-20130266878-A1 HYDROGEN STORAGE SYSTEM INCLUDING A LITHIUM CONDUCTOR GM Global Technology Operations LLC (US) 2013-10-10 US claimed
US-20090227808-A1 Advanced preparation method of organic-transition metal hydride complexes as hydrogen storage materials HANWHA CHEMICAL CORPORATION (KP) 2009-09-10 US claimed
CN-101525345-A Advanced preparation method of organic-transition metal hydride used as hydrogen storage materials HANWHA CHEMICAL CORP 2009-09-09 CN claimed
CN-101522698-A Organometallic complexes as hydrogen storage materials and a method of preparing the same SEOUL NAT UNIV IND FOUNDATION (KR) 2009-09-02 CN claimed
EP-2064221-A1 ORGANOMETALLIC COMPLEXES AS HYDROGEN STORAGE MATERIALS AND A METHOD OF PREPARING THE SAME Seoul National University Industry Foundation (KR) 2009-06-03 EP claimed
US-7485691-B1 Polysilane compositions, methods for their synthesis and films formed therefrom KOVIO, INC (US) 2009-02-03 US claimed
WO-2008094007-A1 POLYMER-METAL HYDRIDE COMPLEXES CONTAINING AROMATIC GROUP AS HYDROGEN STORAGE MATERIALS AND A METHOD OF PREPARING THE SAME SEOUL NATIONAL UNIVERSITY INDUSTRY FOUNDATION (KR) 2008-08-07 WO claimed
WO-2008032985-A1 ORGANOMETALLIC COMPLEXES AS HYDROGEN STORAGE MATERIALS AND A METHOD OF PREPARING THE SAME SEOUL NATIONAL UNIVERSITY INDUSTRY FOUNDATION (KR) 2008-03-20 WO claimed
US-20070264182-A1 Reversible hydrogen storage systems GM GLOBAL TECHNOLOGY OPERATIONS, INC. (US) 2007-11-15 US claimed
WO-2005107334-A1 FILM-TYPE GETTER AND PRODUCING METHOD THEREOF LEE BYOUNGCHUL (KR) 2005-11-10 WO claimed
US-5686603-A DERIVED FROM CARBOHYDRATES, SUGARS LEVER BROTHERS COMPANY, DIVISION OF CONOPCO, INC. (US) 1997-11-11 US claimed