SCHEMBL609088

SCHEMBL609088

[Ca+2].[CaH2].[H-].[H-]

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
SCHEMBL3404050 0.82
SCHEMBL28013365 0.82
SCHEMBL28344824 0.82
SCHEMBL2465866 0.82
SCHEMBL20375 0.82
SCHEMBL2774956 0.82
Water SCHEMBL25301078 0.67
SCHEMBL11864773 0.67
SCHEMBL1892176 0.67
SCHEMBL1892177 0.67

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 9 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9028671-B2 Hydrogen sensing apparatus and method CAMBRIDGE ENTERPRISE LIMITED (GB) 2015-05-12 US disclosed
US-20120037516-A1 HYDROGEN SENSING APPARATUS AND METHOD CAMBRIDGE ENTERPRISE LIMITED (GB) 2012-02-16 US disclosed
WO-2011105989-A2 REVERSIBLE HYDRIDE THERMAL ENERGY STORAGE CELL OPTIMIZE FOR SOLAR APPLICATIONS BLIESNER WAYNE THOMAS (US) 2011-09-01 WO disclosed
US-20110100356-A1 Reversible hydride thermal energy storage cell optimized for solar applications BLIESNER WAYNE THOMAS 2011-05-05 US disclosed
WO-2010147674-A2 A SOLAR ENERGY STORAGE AND COLLECTION SYSTEM BLIESNER WAYNE (US) 2010-12-23 WO disclosed
US-20050252789-A1 Hydrogen sensing apparatus and method CAMBRIDGE ENTERPRISE LIMITED (GB) 2005-11-17 US disclosed
EP-1537410-A1 HYDROGEN SENSING APPARATUS AND METHOD CAMBRIDGE UNIVERSITY TECHNICAL SERVICES LIMITED (GB) 2005-06-08 EP disclosed
WO-2004025289-A1 HYDROGEN SENSING APPARATUS AND METHOD CAMBRIDGE UNIVERSITY TECHNICAL SERVICES LIMITED (GB) 2004-03-25 WO disclosed
US-4882032-A Hydrogen probe GENERAL MOTORS CORPORATION (US) 1989-11-21 US disclosed