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 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MEN1 known ✓ | O00255 | 4/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 8/20 | 0.47 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.42 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.41 |
| ▸ | LMNA | P02545 | 1/20 | 0.40 |
| ▸ | GAA | P10253 | 3/20 | 0.39 |
| ▸ | ELANE | P08246 | 2/20 | 0.39 |
| ▸ | POLB | P06746 | 1/20 | 0.37 |
| ▸ | CA12 | O43570 | 2/20 | 0.37 |
| ▸ | CA9 | Q16790 | 2/20 | 0.37 |
| ▸ | MAPT | P10636 | 2/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.36 |
| ▸ | HPGD | P15428 | 1/20 | 0.36 |
| ▸ | RAB9A | P51151 | 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.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| Sodium Dehydroacetate SCHEMBL41960 | 0.98 | ALDH1A1 (0.48) | ALDH1A1MEN1KMT2AL3MBTL1SMN1; SMN2 | |
| SCHEMBL5310052 | 0.98 | ALDH1A1 (0.48) | ALDH1A1MEN1KMT2AL3MBTL1SMN1; SMN2 | |
| Chloroxylenol SCHEMBL11390027 | 0.83 | CYP3A4 (0.44) | ALDH1A1MEN1KMT2AL3MBTL1SMN1; SMN2 | |
| Benzoic Acid SCHEMBL628349 | 0.83 | ALDH1A1 (0.50) | ALDH1A1MEN1KMT2AL3MBTL1SMN1; SMN2 | |
| Benzyl Alcohol SCHEMBL7606090 | 0.82 | ALDH1A1 (0.58) | ALDH1A1MEN1KMT2ASMN1; SMN2LMNA | |
| Ethylene Glycol SCHEMBL14335299 | 0.81 | ALDH1A1 (0.40) | ALDH1A1MEN1KMT2AL3MBTL1SMN1; SMN2 | |
| SCHEMBL1308058 | 0.77 | KMT2A (0.59) | ALDH1A1MEN1KMT2AL3MBTL1SMN1; SMN2 | |
| SCHEMBL11227804 | 0.76 | KMT2A (0.58) | ALDH1A1MEN1KMT2AL3MBTL1SMN1; SMN2 | |
| Oxyquinoline SCHEMBL11450944 | 0.75 | COMT (0.48) | ALDH1A1MEN1KMT2AL3MBTL1SMN1; SMN2 | |
| SCHEMBL6415919 | 0.73 | CYP3A4 (0.50) | ALDH1A1MEN1KMT2AL3MBTL1SMN1; SMN2 |
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 42 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-20250090438-A1 | NANOEMULSION ENDOWED WITH ANTISEPTIC EFFECT | MORESCO CORPORATION (JP) | 2025-03-20 | — | — | US | disclosed |
| CN-114171183-B | Microwave breast tumor classification method based on deep learning | 太原理工大学 | 2025-02-21 | — | — | CN | disclosed |
| EP-4470527-A1 | NANOEMULSION ENDOWED WITH ANTISEPTIC EFFECT | MORESCO Corporation (JP) | 2024-12-04 | — | — | EP | disclosed |
| CN-118591370-A | Nanoemulsion imparted with preservative effect | 株式会社MORESCO | 2024-09-03 | — | — | CN | disclosed |
| WO-2023139907-A1 | NANOEMULSION ENDOWED WITH ANTISEPTIC EFFECT | 株式会社MORESCO | 2023-07-27 | — | — | WO | disclosed |
| CN-114171183-A | Microwave breast tumor classification method based on deep learning | 太原理工大学 | 2022-03-11 | — | — | CN | disclosed |
| CN-212942885-U | Reaction tank for producing sodium dehydroacetate | 杭州鸿满化工有限公司 | 2021-04-13 | — | — | CN | disclosed |
| CN-210021298-U | Filter membrane filter equipment is used in sodium dehydroacetate production | 经纬精细化工(南通)有限公司 | 2020-02-07 | — | — | CN | disclosed |
| CN-110313571-A | A kind of dried yak beef and its production technology | 成都伍田食品有限公司 | 2019-10-11 | — | — | CN | disclosed |
| CN-110313606-A | A kind of yak meat and its preparation process | 成都伍田食品有限公司 | 2019-10-11 | — | — | CN | disclosed |
| EP-1363494-A1 | PRESERVATIVE BLENDS CONTAINING QUATERNARY AMMONIUM COMPOUNDS | LONZA, INC. (US) | 2003-11-26 | — | — | EP | disclosed |
| EP-1363497-A1 | COMBINATION OF AN IODOPROPYNYL DERIVATIVE WITH A KETONE ACID OR ITS SALT AND/OR WITH AN AROMATIC CARBOXYLIC ACID OR ITS SALT | LONZA INC. (US) | 2003-11-26 | — | — | EP | disclosed |
| EP-0841890-B1 | COSMETIC POWDER COMPOSITIONS HAVING IMPROVED SKIN COVERAGE | PROCTER & GAMBLE (US) | 2003-01-22 | — | — | EP | disclosed |
| US-20020165283-A1 | Preservative blends containing quaternary ammonium compounds | LONZA INC. | 2002-11-07 | — | — | US | disclosed |
| WO-2002069710-A1 | PRESERVATIVE BLENDS CONTAINING QUATERNARY AMMONIUM COMPOUNDS | LONZA, INC. (US) | 2002-09-12 | — | — | WO | disclosed |
| WO-2002069716-A1 | COMBINATION OF AN IODOPROPYNYL DERIVATIVE WITH A KETONE ACID OR ITS SALT AND/OR WITH AN AROMATIC CARBOXYLIC ACID OR ITS SALT | LONZA INC. (US) | 2002-09-12 | — | — | WO | disclosed |
| US-20010031168-A1 | Packaging and applicator device including a porous structure incorporating a biocidal agent | L'OREAL S.A. (FR) | 2001-10-18 | — | — | US | disclosed |
| EP-0841890-A1 | COSMETIC POWDER COMPOSITIONS HAVING IMPROVED SKIN COVERAGE | THE PROCTER & GAMBLE COMPANY (US) | 1998-05-20 | — | — | EP | disclosed |
| US-5683706-A | TALC OF SPECIFIC PARTICLE SIZES AND ABSORBERS | THE PROCTOR & GAMBLE COMPANY (US) | 1997-11-04 | — | — | US | disclosed |
| WO-1997004737-A1 | COSMETIC POWDER COMPOSITIONS HAVING IMPROVED SKIN COVERAGE | THE PROCTER & GAMBLE COMPANY (US) | 1997-02-13 | — | — | WO | disclosed |
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.
| Patent | Title | Text reads most about | Predicted target · text-rank |
|---|---|---|---|
| US-20020165283-A1 | Preservative blends containing quaternary ammonium compounds | HCN3, C9, ACMSD | MEN1 2945/4885ALDH1A1 478/4885KMT2A 819/4885 |
“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.