Water

Water

SCHEMBL3067491

O=[Si]([O-])[O-].[Ca+2].[Na+].[OH-]

nearest known ligand 0.00

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

GABBR1GABBR2GABRA1GABRA2GABRA3GABRA4GABRA5GABRA6GABRB1GABRB2GABRB3GABRDGABREGABRG1GABRG2GABRG3GABRPGABRQGRIN1GRIN2AGRIN2BGRIN2CGRIN2DGRIN3AGRIN3BHMGCRMMP1MMP13MMP7MMP8PTGS1PTGS2ileSpolrplArplBrplCrplDrplErplFrplJrplKrplLrplMrplNrplOrplPrplQrplRrplSrplTrplUrplVrplWrplXrplYrpmArpmBrpmCrpmDrpmErpmFrpmGrpmHrpmIrpmJrpsArpsBrpsCrpsDrpsErpsFrpsGrpsHrpsIrpsJrpsKrpsLrpsMrpsNrpsOrpsPrpsQrpsRrpsSrpsTrpsUykgMykgO

The experimentally established mechanism targets of Water. 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 SCHEMBL6248049 0.95
Water SCHEMBL914728 0.95
Water SCHEMBL2781813 0.94
Water SCHEMBL617016 0.94
Water SCHEMBL11792279 0.94
SCHEMBL449484 0.94
Water SCHEMBL18108508 0.91
Water SCHEMBL7034741 0.91
Water SCHEMBL6243762 0.89
Water SCHEMBL9056814 0.89

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7579084-B2 Ceramic material, compositions and methods for manufacture thereof CAROMA INDUSTRIES LIMITED (AU) 2009-08-25 US claimed
US-20080300129-A1 CERAMIC MATERIAL, COMPOSITIONS AND METHODS FOR MANUFACTURE THEREOF CAROMA INSDUSTRIES LIMITED (AU) 2008-12-04 US claimed
WO-2008145361-A1 MINERAL-FIBER SOLID DISPERSION, METHOD FOR PREPARING THE SAME, AND USE THEREOF AS PHARMACEUTICAL TABLETING AID THE JORDANIAN PHARMACEUTICAL MANUFACTURING CO. (JO) 2008-12-04 WO claimed
EP-1997480-A1 Mineral-fiber solid dispersion, method for preparing the same and use thereof as pharmaceutical tableting aid The Jordanian Pharmaceutical Manufacturing Co. (JO) 2008-12-03 EP claimed
US-20070149383-A1 Ceramic material, compositions and methods for manufacture thereof CAROMA INSDUSTRIES LIMITED (AU) 2007-06-28 US claimed
US-20250256971-A1 Compositions and Methods for the Capture of Carbon Dioxide and/or the Generation of Silica OHIO STATE INNOVATION FOUNDATION 2025-08-14 US disclosed
US-12168747-B2 Aerogel compositions for high temperature applications ASPEN AEROGELS, INC. (US) 2024-12-17 US disclosed
US-20240360363-A1 AEROGEL COMPOSITIONS FOR HIGH TEMPERATURE APPLICATIONS ASPEN AEROGELS, INC. 2024-10-31 US disclosed
US-11634641-B2 Aerogel compositions for high temperature applications ASPEN AEROGELS, INC. (US) 2023-04-25 US disclosed
US-11549059-B2 Aerogel compositions with enhanced performance MIDCAP FUNDING IV TRUST 2023-01-10 US disclosed
US-11261380-B2 Aerogel compositions for high temperature applications MIDCAP FUNDING IV TRUST 2022-03-01 US disclosed
US-20210207032-A1 AEROGEL COMPOSITIONS FOR HIGH TEMPERATURE APPLICATIONS ASPEN AEROGELS, INC. (US) 2021-07-08 US disclosed
US-9181486-B2 Aerogel compositions with enhanced performance ASPEN AEROGELS, INC. (US) 2015-11-10 US disclosed
US-7790795-B2 Scratch and mar resistant polymer compositions, methods for making and articles made from the same EXXONMOBIL CHEMICAL PATENTS INC. (US) 2010-09-07 US disclosed
WO-2008145361-A1 MINERAL-FIBER SOLID DISPERSION, METHOD FOR PREPARING THE SAME, AND USE THEREOF AS PHARMACEUTICAL TABLETING AID THE JORDANIAN PHARMACEUTICAL MANUFACTURING CO. (JO) 2008-12-04 WO disclosed
EP-1997480-A1 Mineral-fiber solid dispersion, method for preparing the same and use thereof as pharmaceutical tableting aid The Jordanian Pharmaceutical Manufacturing Co. (JO) 2008-12-03 EP disclosed
WO-2007140293-A2 AEROGEL COMPOSITIONS WITH ENHANCED PERFORMANCE ASPEN AEROGELS, INC. (US) 2007-12-06 WO disclosed
WO-2007139622-A2 SCRATCH AND MAR RESISTANT POLYMER COMPOSITIONS, METHODS FOR MAKING AND ARTICLES MADE FROM THE SAME EXXONMOBIL CHEMICAL PATENTS INC. (US) 2007-12-06 WO disclosed
US-20070272902-A1 AEROGEL COMPOSITIONS WITH ENHANCED PERFORMANCE ASPEN AEROGELS, INC. (US) 2007-11-29 US disclosed
US-20070276063-A1 Scratch and mar resistant polymer compositions, methods for making and articles made from the same EXXONMOBIL CHEMICAL PATENTS INC. 2007-11-29 US disclosed