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 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.35 |
| ▸ | TP53 | P04637 | 1/20 | 0.35 |
| ▸ | TSHR | P16473 | 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.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| Water SCHEMBL31522142 | 1.00 | ALDH1A1 (0.35) | ALDH1A1TP53TSHR | |
| SCHEMBL1962768 | 0.96 | ALDH1A1 (0.38) | ALDH1A1TP53TSHR | |
| Water SCHEMBL8828341 | 0.86 | ALDH1A1 (0.32) | ALDH1A1TP53TSHR | |
| SCHEMBL4184754 | 0.81 | ALDH1A1 (0.33) | ALDH1A1TP53TSHR | |
| SCHEMBL5861894 | 0.81 | ALDH1A1 (0.41) | ALDH1A1TP53TSHR | |
| SCHEMBL688151 | 0.81 | ALDH1A1 (0.33) | ALDH1A1TP53TSHR | |
| SCHEMBL9935046 | 0.76 | THRB (0.30) | ALDH1A1TP53TSHR | |
| SCHEMBL3958692 | 0.76 | ALDH1A1 (0.37) | ALDH1A1TP53TSHR | |
| SCHEMBL19397 | 0.72 | — | — | |
| SCHEMBL245872 | 0.72 | — | — |
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 967 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2775842-B1 | 1-substituted-5-fluoro-3,6-dihydro-6-imino-2(1H)-pyrimidinone derivatives as fungicidal agents for use in plant protection | ADAMA MAKHTESHIM LTD (IL) | 2017-10-04 | — | — | EP | claimed |
| US-7795456-B2 | Insecticidal N-substituted sulfoximines | DOW AGROSCIENCES LLC (US) | 2010-09-14 | — | — | US | claimed |
| WO-2026101907-A1 | MIXTURES FOR FUNGAL CONTROL IN CEREALS | CORTEVA AGRISCIENCE LLC (US) | 2026-05-15 | — | — | WO | disclosed |
| WO-2026101910-A1 | FUNGICIDAL FORMULATIONS CONTAINING ARYL AMIDINES AND METHODS OF USE | CORTEVA AGRISCIENCE LLC (US) | 2026-05-15 | — | — | WO | disclosed |
| WO-2026101906-A1 | MIXTURES FOR FUNGAL CONTROL IN CORN | CORTEVA AGRISCIENCE LLC (US) | 2026-05-15 | — | — | WO | disclosed |
| WO-2026101908-A1 | MIXTURES FOR FUNGAL CONTROL IN SOYBEANS | CORTEVA AGRISCIENCE LLC (US) | 2026-05-15 | — | — | WO | disclosed |
| US-12616081-B2 | High precision greenhouse seed and seedling treatment | SYNGENTA CROP PROTECTION AG (CH) | 2026-05-05 | — | — | US | disclosed |
| US-20260117244-A1 | INHIBITORY RNA FOR THE CONTROL OF PHYTOPATHOGENS | THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) | 2026-04-30 | — | — | US | disclosed |
| US-12590317-B2 | Polynucleotides and methods for transferring resistance to Asian soybean rust | PIONEER HI-BRED INTERNATIONAL, INC. (US) | 2026-03-31 | — | — | US | disclosed |
| US-12575573-B2 | Methods of using a colloidal silver-based composition in reducing or preventing microbial contamination in plants or explants in tissue culture processes | Clearleaf Inc. (US) | 2026-03-17 | — | — | US | disclosed |
| EP-4680029-A1 | LIQUID COMPOSITIONS CONTAINING 5-(FLUORO-4-IMINO-3-METHYL)-1-TOSYL-3,4 DIHYDROPYRIMIDINE-(1H)-ONE AND DERIVATIVES THEREOF AND A UV ABSORBER | ADAMA MAKHTESHIM LTD. (IL) | 2026-01-21 | — | — | EP | disclosed |
| US-4496712-A | MONOSUBSTITUTED HYDROQUINONONES, TEREPHTHALIC ACID, AND DISUBSTITUTED DIPHENYL ETHERS | E. I. DU PONT DE NEMOURS AND COMPANY (US) | 1985-01-29 | — | — | US | disclosed |
| US-4487916-A | Melt-spinnable copolyesters | E.I. DU PONT DE NEMOURS AND COMPANY (US) | 1984-12-11 | — | — | US | disclosed |
| EP-0102749-A1 | Fiber-forming polyesters of ketodiols | E.I. DU PONT DE NEMOURS AND COMPANY (US) | 1984-03-14 | — | — | EP | disclosed |
| EP-0102757-A1 | Fiber-forming polyesters of aromatic ketohydroxy acids | E.I. DU PONT DE NEMOURS AND COMPANY (US) | 1984-03-14 | — | — | EP | disclosed |
| US-4399270-A | MELT SPINNABLE AND ANISTROPIC; MOLDING MATERIALS; TEXTILES; TEXTILE STRENGTH | E. I. DU PONT DE NEMOURS & CO. (US) | 1983-08-16 | — | — | US | disclosed |
| US-4398015-A | POLYLACTONES; HIGH TENACITY FILAMENTS | E. I. DU PONT DE NEMOURS & COMPANY (US) | 1983-08-09 | — | — | US | disclosed |
| US-4245082-A | Polyesters derived from 3,4'-dihydroxy-benzophenones or 3-hydroxy-4'-(4-hydroxyphenyl-)benzophenone and certain aromatic dicarboxylic acids and filaments thereof | E. I. DU PONT DE NEMOURS AND COMPANY (US) | 1981-01-13 | — | — | US | disclosed |
| US-4239884-A | FRIEDEL CRAFTS CATALYST FORMING COMPLEX WITH POLYKETONE OR POLYKETONE-SULFONE BUT CRYSTALLIZING OUT THE POLYMER UPON BASIFICATION OF | RAYCHEM CORPORATION (US) | 1980-12-16 | — | — | US | disclosed |
| US-4183895-A | INCREASING TENSILE STRENGTH OF ORIENTED FIBERS BY HEAT TREATMENT IN RELAXED CONDITION | E. I. DU PONT DE NEMOURS AND COMPANY (US) | 1980-01-15 | — | — | US | 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 (4 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-12616081-B2 | High precision greenhouse seed and seedling treatment | DCX, MYB, CROCC | ALDH1A1 845/4885TP53 2475/4885TSHR 4009/4885 |
| US-20260117244-A1 | INHIBITORY RNA FOR THE CONTROL OF PHYTOPATHOGENS | ATG13, MAVS, ATG7 | ALDH1A1 4793/4885TP53 1481/4885TSHR 2410/4885 |
| US-12575573-B2 | Methods of using a colloidal silver-based composition in reducing or preventing microbial contamination in plants or explants in tissue culture processes | ALG1, MYB, CHIT1 | ALDH1A1 2088/4885TP53 797/4885TSHR 2535/4885 |
| US-12590317-B2 | Polynucleotides and methods for transferring resistance to Asian soybean rust | SRRT, PHAX, ERN2 | ALDH1A1 4878/4885TP53 3842/4885TSHR 1378/4885 |
“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.