Water

Water

SCHEMBL74669

O.O=[N+]([O-])[O-].O=[N+]([O-])[O-].O=[N+]([O-])[O-].[La+3]

nearest known ligand 0.67

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

ABCC9ABL1ACEACHEACVR1ADORA1ADORA2AADORA2BADORA3ADRA1AADRA1BADRA1DADRA2AADRA2BADRA2CADRB1ADRB2ADRB3AGTR1ALOX5ATP4AATP4BBCRBTKCACNA1ACACNA1BCACNA1CCACNA1DCACNA1ECACNA1FCACNA1GCACNA1HCACNA1ICACNA1SCACNA2D1CACNA2D2CACNA2D3CACNA2D4CACNB1CACNB2CACNB3CACNB4CACNG1CACNG2CACNG3CACNG4CACNG5CACNG6CACNG7CACNG8CALCRLCFBCHRM1CHRM2CHRM3CHRM4CHRM5CHRNA1CHRNB1CHRNDCHRNECHRNGCRBNCUL4ACXCR1CXCR2DDB1DDCDHFRDPP4DRD2DRD3DRD4EGFRERBB2ERBB4ESR1ESR2FDPSFKBP1AFLT1FLT3FLT4GARTGHSRGRIA1GRIA2GRIA3GRIA4GRIK1GRIK2GRIK3GRIK4GRIK5GRIN2AGSK3AGSK3BHDAC1HDAC10HDAC11HDAC2HDAC3HDAC4HDAC5HDAC6HDAC7HDAC8HDAC9HRH1HTR1AHTR1BHTR1DHTR1EHTR1FHTR2AHTR2BHTR2CHTR3AHTR3BHTR3CHTR3DHTR3EHTR4HTR5AHTR6HTR7IDH1IDH2IMPA1ITGA2BITGB3JAK1JAK2JAK3KCNJ11KCNK3KCNK9KDRKITMEN1METMMP1MMP13MMP7MMP8NANOD2NS5bODC1OPG057OPRD1OPRK1OPRM1PPARP1PARP2PDE3APDE3BPDE4APDE4BPDE4CPDE4DPDGFRBPIK3CAPIK3CBPIK3CDPIK3CGPIK3R1PIK3R2PIK3R3PIK3R5PKLRPPARDPPATPTGS1PTGS2RBX1ROCK1ROCK2RRM1RRM2RRM2BSCN10ASCN11ASCN1ASCN2ASCN3ASCN4ASCN5ASCN7ASCN8ASCN9ASCNN1ASCNN1BSCNN1GSIGMAR1SLC10A2SLC5A2SLC6A2SLC6A3SLC6A4SLC9A3SYKTACR1THRATHRBTOP1TUBA1ATUBA1BTUBA1CTUBA3CTUBA3ETUBA4ATUBBTUBB1TUBB2ATUBB2BTUBB3TUBB4ATUBB4BTUBB6TUBB8TYK2TYMSVDRampCblablaT-3blaT-4blaT-5blaT-6blaUOE-1dacAdacBdacCfolAfolPftsIgyrAgyrBileSmecAmrcAmrcBmrdAparCparEpbp2pbp4pbpApbpFrplArplBrplCrplDrplErplFrplIrplJrplKrplLrplMrplNrplOrplPrplQrplRrplSrplTrplUrplVrplWrplXrplYrpmArpmBrpmCrpmDrpmErpmE2rpmFrpmGrpmG1rpmG2rpmG3rpmHrpmIrpmJrpsArpsBrpsCrpsDrpsErpsFrpsGrpsHrpsIrpsJrpsKrpsLrpsMrpsNrpsOrpsPrpsQrpsRrpsSrpsTrpsUthyAykgMykgO

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.

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
MEN1 known ✓ O00255 1/20 0.67
KMT2A Q03164 1/20 0.67
CA5A P35218 1/20 0.46
CA5B Q9Y2D0 1/20 0.46
TSHR P16473 3/20 0.39
ALDH1A1 P00352 3/20 0.39
TDP1 Q9NUW8 1/20 0.39
HPGD P15428 1/20 0.36
HIF1A Q16665 1/20 0.36

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

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 SCHEMBL20393989 1.00 MEN1 (0.67) MEN1KMT2ACA5ACA5BTSHR
Water SCHEMBL9151463 1.00 MEN1 (0.67) MEN1KMT2ACA5ACA5BTSHR
Water SCHEMBL5067331 1.00 MEN1 (0.67) MEN1KMT2ACA5ACA5BTSHR
Water SCHEMBL1900782 1.00 MEN1 (0.67) MEN1KMT2ACA5ACA5BTSHR
Water SCHEMBL72442 1.00 MEN1 (0.67) MEN1KMT2ACA5ACA5BTSHR
Water SCHEMBL12471279 1.00 MEN1 (0.67) MEN1KMT2ACA5ACA5BTSHR
Water SCHEMBL6727854 0.94 MEN1 (0.60) MEN1KMT2ACA5ACA5BTSHR
Water SCHEMBL10867031 0.94 MEN1 (0.60) MEN1KMT2ACA5ACA5BTSHR
Water SCHEMBL5576323 0.94 MEN1 (0.60) MEN1KMT2ACA5ACA5BTSHR
Water SCHEMBL10867036 0.94 MEN1 (0.60) MEN1KMT2ACA5ACA5BTSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-122037934-A Ethylene glycol regulated rare earth europium doped Sr2LaF7Nanometer material and preparation method and application thereof 上海应用技术大学 2026-05-15 CN claimed
US-20260061401-A1 PREPARATION METHOD OF COMPOSITE CATALYTIC MATERIAL FOR DEGRADING MICROPLASTICS IN WATER BEIJING MUNICIPAL RES INSTITUTE OF ECO ENVIRONMENTAL PROTECTION (CN) 2026-03-05 US claimed
EP-4630187-A1 PRODUCTION OF SILVER NANOPARTICLES BY GREEN SYNTHESIS USING HAZELNUT HUSK EXTRACT Bahçesehir Üniversitesi (TR) 2025-10-15 EP claimed
US-20250198996-A1 EXTENDED LIVE CELL BARCODING APPROACH FOR MULTIPLEXED MASS CYTOMETRY BOARD OF REGENTS, THE UNIVERSITY OF TEXAS SYSTEM (US) 2025-06-19 US claimed
CN-119797387-B Method for preparing nano lanthanum hexaboride by hydration lanthanum chloride assisted microwave solid-phase combustion 江西善纳新材料科技有限公司 2025-06-10 CN claimed
US-20250171674-A1 LIGHT-ABSORBING HEAT-STORAGE COMPOSITE MATERIAL AND PREPARATION METHOD THEREOF SHANXI SANSHUI ENERGY CO LTD (CN) 2025-05-29 US claimed
CN-119082661-B Corrosion-resistant heat-resistant steel co-doped with ternary trace elements and preparation method thereof 兴化市精密铸钢有限公司 2025-05-16 CN claimed
CN-119797387-A Method for preparing nano lanthanum hexaboride by hydration lanthanum chloride assisted microwave solid-phase combustion 江西善纳新材料科技有限公司 2025-04-11 CN claimed
CN-119775963-A Preparation method and application of metal ion doped ultra-small cerium oxide polishing abrasive 复旦大学 2025-04-08 CN claimed
CN-119591473-A Method for synthesizing glycol from hemicellulose 福州大学 2025-03-11 CN claimed
EP-1815908-A1 Exhaust gas purification catalyst Mazda Motor Corporation (JP) 2007-08-08 EP claimed
US-20070179054-A1 EXHAUST GAS PURIFICATION CATALYST MAZDA MOTOR CORPORATION (JP) 2007-08-02 US claimed
US-20060229478-A1 Palladium-based catalyst for selective hydrogenation of acetylene BASF AKTIENGESELLSCHAFT (DE) 2006-10-12 US claimed
EP-1656363-A2 PROCESS FOR THE PREPARATION OF N-GLYCIDYLAMINES Huntsman Advanced Materials (Switzerland) GmbH (CH) 2006-05-17 EP claimed
WO-2005003109-A2 PROCESS FOR THE PREPARATION OF N-GLYCIDYLAMINES HUNTSMAN ADVANCED MATERIALS (SWITZERLAND) GMBH (CH) 2005-01-13 WO claimed
EP-0422105-B1 METAL OXIDE CERAMIC POWDERS AND METHODS OF MAKING SAME BATTELLE MEMORIAL INSTITUTE (US) 1994-09-07 EP claimed
US-5114702-A Method of making metal oxide ceramic powders by using a combustible amino acid compound BATTELLE MEMORIAL INSTITUTE (US) 1992-05-19 US claimed
EP-0422105-A4 METAL OXIDE CERAMIC POWDERS AND THIN FILMS AND METHODS OF MAKING SAME 1992-01-08 EP claimed
EP-0422105-A1 METAL OXIDE CERAMIC POWDERS AND METHODS OF MAKING SAME. BATTELLE MEMORIAL INSTITUTE (US) 1991-04-17 EP claimed
WO-1989012027-A1 METAL OXIDE CERAMIC POWDERS AND THIN FILMS AND METHODS OF MAKING SAME BATTELLE MEMORIAL INSTITUTE (US) 1989-12-14 WO claimed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20260061401-A1 PREPARATION METHOD OF COMPOSITE CATALYTIC MATERIAL FOR DEGRADING MICROPLASTICS IN WATER CA3, SOD1, ACLY MEN1 3790/4885KMT2A 4003/4885CA5A 353/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.