SCHEMBL2468148

SCHEMBL2468148

[Ca+2].[CaH2].[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
SCHEMBL20210819 0.82
SCHEMBL11505569 0.82
SCHEMBL6239687 0.82
SCHEMBL11674077 0.82
SCHEMBL10576947 0.82
SCHEMBL9778052 0.82
SCHEMBL7042759 0.82
SCHEMBL5067686 0.82
SCHEMBL8663059 0.82
SCHEMBL11694371 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 12 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2023081474-A9 PHOSPHONATE-BASED COORDINATION COMPLEXES AND METHODS OF PREPARATION AND USE THEREOF UNIVERSITY OF PUERTO RICO (US) 2024-04-25 WO disclosed
US-20240082210-A1 CROMOLYN METAL COMPLEXES AS ENHANCED PHARMACEUTICAL FORMULATIONS AND METHOD OF USING THE SAME LOPEZ MEJIAS VILMALI (US) 2024-03-14 US disclosed
US-11865101-B2 Cromolyn metal complexes as enhanced pharmaceutical formulations and method of preparing the same UNIVERSITY OF PUERTO RICO (US) 2024-01-09 US disclosed
WO-2023081474-A2 PHOSPHONATE-BASED COORDINATION COMPLEXES AND METHODS OF PREPARATION AND USE THEREOF UNIVERSITY OF PUERTO RICO (US) 2023-05-11 WO disclosed
EP-2935153-B1 BODY MADE OF A CERAMIC MATERIAL BASED ON ZIRCONIA STRAUMANN HOLDING AG (CH) 2022-06-15 EP disclosed
US-20210338628-A1 Cromolyn Metal Complexes as enhanced pharmaceutical formulations and method of preparing the same UNIVERSITY OF PUERTO RICO (PR) 2021-11-04 US disclosed
US-10752553-B2 Body made of a ceramic material STRAUMANN HOLDING AG (CH) 2020-08-25 US disclosed
US-20150315085-A1 BODY MADE OF A CERAMIC MATERIAL STRAUMANN HOLDING AG (CH) 2015-11-05 US disclosed
EP-2935153-A1 BODY MADE OF A CERAMIC MATERIAL Straumann Holding AG (CH) 2015-10-28 EP disclosed
WO-2014101997-A1 BODY MADE OF A CERAMIC MATERIAL STRAUMANN HOLDING AG (CH) 2014-07-03 WO disclosed
EP-2364092-A1 PLANT WASH Ellis, Roger Rolland (US) 2011-09-14 EP disclosed
US-5534292-A Method for producing and curing hydraulic material MITSUO KOJI (JP) 1996-07-09 US disclosed