Water

Water

SCHEMBL72731

O.O=S(=O)(O)CC(O)CN1CCN(CCO)CC1

nearest known ligand 0.46

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 13)

geneUniProtsupporting neighboursconfidence
CHRM2 known ✓ P08172 1/20 0.36
CHRM1 known ✓ P11229 1/20 0.36
ADRB2 known ✓ P07550 1/20 0.36
MEN1 known ✓ O00255 2/20 0.35
KMT2A Q03164 3/20 0.46
LMNA P02545 1/20 0.46
HTT P42858 1/20 0.46
ALDH1A1 P00352 4/20 0.39
KDM4E B2RXH2 2/20 0.38
TP53 P04637 1/20 0.37
MAPT P10636 1/20 0.37
ATM Q13315 1/20 0.37
HSD17B10 Q99714 1/20 0.35

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 SCHEMBL1444204 1.00 KMT2A (0.46) KMT2ALMNAHTTALDH1A1KDM4E
Water SCHEMBL20475938 1.00 KMT2A (0.46) KMT2ALMNAHTTALDH1A1KDM4E
Water SCHEMBL6936586 1.00 KMT2A (0.46) KMT2ALMNAHTTALDH1A1KDM4E
SCHEMBL72732 0.98 KMT2A (0.47) KMT2ALMNAHTTALDH1A1KDM4E
SCHEMBL20495576 0.98 KMT2A (0.47) KMT2ALMNAHTTALDH1A1KDM4E
Water SCHEMBL15641759 0.97 KMT2A (0.44) KMT2ALMNAHTTALDH1A1KDM4E
Water SCHEMBL2725823 0.94 KMT2A (0.41) KMT2ALMNAHTTALDH1A1KDM4E
SCHEMBL555799 0.92 KMT2A (0.42) KMT2ALMNAHTTALDH1A1KDM4E
Water SCHEMBL955959 0.89 KMT2A (0.43) KMT2AHTTKDM4EMAPTATM
Water SCHEMBL1061545 0.89 KMT2A (0.43) KMT2AHTTKDM4EMAPTATM

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

Appears in 6574 patents — a generic fragment claimed broadly, so it's down-weighted as IP noise. Top by claim status then date:

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2026101351-A1 METHOD FOR PREPARING LIPID NANOPARTICLES 주식회사 테르나테라퓨틱스 2026-05-15 WO claimed
EP-4739416-A1 METHOD OF PURIFICATION CSL Behring AG (CH) 2026-05-13 EP claimed
EP-3986465-B1 SITE-SPECIFIC, KINETICALLY INERT CONJUGATION OF LABELS AND/OR CARRIERS TO TARGET MOLECULES SUCH AS HIS-TAGGED PROTEINS VIA METAL COMPLEX REAGENTS MAX PLANCK GESELLSCHAFT (DE) 2026-05-13 EP claimed
EP-4739992-A1 DETECTION OF TARGET MOLECULES IN DRIED BIOLOGIC MATRICES SomaLogic Operating Co., Inc. (US) 2026-05-13 EP claimed
WO-2026085618-A1 METHOD OF IMMOBILIZING CAPTURE PROBES TO SOLID PHASES FOR TARGET SUBSTANCE DETECTION YYZ PHARMATECH INC. (CA) 2026-04-30 WO claimed
EP-4724588-A1 A METHOD OF ENHANCED SEPARATION OF FULL ADENO-ASSOCIATED VIRUS (AAV) CAPSIDS Sartorius BIA Separations d.o.o. (SI) 2026-04-15 EP claimed
US-20260085339-A1 PATHOGEN TESTING DEVICE AND METHOD RT MICRODX INC (US) 2026-03-26 US claimed
US-12582670-B2 Lignin solvation using aqueous biologically compatible buffers UNIVERSITY OF FLORIDA RESEARCH FOUNDATION, INCORPORATED (US) 2026-03-24 US claimed
US-20260077091-A1 INJECTABLE COLLAGEN IMPLANTS AND COMPOSITIONS AND RELATED SYSTEMS, AND METHODS OF PREPARATION AND USE THEREOF Miach Orthopaedics, Inc. (US) 2026-03-19 US claimed
US-20260077090-A1 INJECTABLE COLLAGEN IMPLANTS AND COMPOSITIONS AND RELATED SYSTEMS, AND METHODS OF PREPARATION AND USE THEREOF Miach Orthopaedics, Inc. (US) 2026-03-19 US claimed
EP-0465510-A1 A STABLE HEMOGLOBIN REFERENCE SOLUTION. BIONOSTICS INC (US) 1992-01-15 EP claimed
CN-1014547-B VIABLE CELL LABELLING SMITHKLINE BECKMAN CORP (US) 1991-10-30 CN claimed
US-5045529-A Tonometric fluid for blood gas and co-oximetry instruments BIONOSTICS, INC. (US) 1991-09-03 US claimed
WO-1990011527-A1 A STABLE HEMOGLOBIN REFERENCE SOLUTION BIONOSTICS, INC. (US) 1990-10-04 WO claimed
US-4914041-A CONTAINING HEPARIN BECKMAN INSTRUMENTS, INC. (US) 1990-04-03 US claimed
EP-0354954-A1 REAGENT AND METHOD FOR DETECTING RHEUMATOID FACTOR. BECKMAN INSTRUMENTS INC (US) 1990-02-21 EP claimed
WO-1989007765-A1 NOVEL BUFFER AND METHOD FOR DETECTING RHEUMATOID FACTOR BECKMAN INSTRUMENTS, INC. (US) 1989-08-24 WO claimed
US-4783401-A CYANINE DYE, OSMOLARITY REGULATOR SMITHKLINE BECKMAN CORPORATION (US) 1988-11-08 US claimed
CN-87107216-A VIABLE CELL LABELLING 1988-05-11 CN claimed
EP-0266194-A2 Viable cell labelling Zynaxis Inc. (US) 1988-05-04 EP claimed