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.
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 SCHEMBL8330424 | 1.00 | — | — | |
| SCHEMBL809285 | 0.97 | — | — | |
| SCHEMBL10487190 | 0.93 | — | — | |
| Water SCHEMBL31538171 | 0.90 | THRB (0.32) | — | |
| SCHEMBL11129024 | 0.90 | — | — | |
| Water SCHEMBL11048626 | 0.88 | LMNA (0.36) | — | |
| SCHEMBL9724351 | 0.87 | LMNA (0.33) | — | |
| Water SCHEMBL11396324 | 0.86 | — | — | |
| SCHEMBL25404599 | 0.84 | LMNA (0.38) | — | |
| SCHEMBL8189397 | 0.84 | LMNA (0.38) | — |
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 29 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-119874465-A | New method for synthesizing fluoroalkyl substituted 4,4' -diaminodiphenyl methane compound | 海南大学 | 2025-04-25 | — | — | CN | claimed |
| CN-119874465-A | New method for synthesizing fluoroalkyl substituted 4,4' -diaminodiphenyl methane compound | 海南大学 | 2025-04-25 | — | — | CN | disclosed |
| EP-3757085-B1 | PERFLUORINATED POLYOLS AND THEIR USE FOR THE ENANTIOMERIC SEPARATION OF CHIRAL ANIONS | CENTRE NAT RECH SCIENT (FR) | 2021-11-10 | — | — | EP | disclosed |
| EP-3757085-A1 | PERFLUORINATED POLYOLS AND THEIR USE FOR THE ENANTIOMERIC SEPARATION OF CHIRAL ANIONS | Centre National de la Recherche Scientifique (FR) | 2020-12-30 | — | — | EP | disclosed |
| WO-2020260437-A1 | PERFLUORINATED POLYOLS AND THEIR USE FOR THE ENANTIOMERIC SEPARATION OF CHIRAL ANIONS | CENTRE NATIONAL DE LA RECHERCHE SCIENTIFIQUE (FR) | 2020-12-30 | — | — | WO | disclosed |
| US-20100217007-A1 | CHEMICAL PROCESS | SYNGENTA CROP PROTECTION, INC. (US) | 2010-08-26 | — | — | US | disclosed |
| EP-1469001-B1 | Corroles, including chiral derivatives and the use thereof | TECHNION RES & DEV FOUNDATION (IL) | 2010-05-05 | — | — | EP | disclosed |
| EP-1928869-B1 | CHEMICAL PROCESS | SYNGENTA PARTICIPATIONS AG (CH) | 2010-03-17 | — | — | EP | disclosed |
| EP-1928869-A1 | CHEMICAL PROCESS | Syngeta Participations AG (CH) | 2008-06-11 | — | — | EP | disclosed |
| WO-2007020460-A1 | CHEMICAL PROCESS | SYNGENTA PARTICIPATIONS AG (CH) | 2007-02-22 | — | — | WO | disclosed |
| EP-0757690-A4 | ELECTRON-DEFICIENT PORPHYRINS AND PROCESSES AND INTERMEDIATES FOR PREPARING SAME | UNIV PENNSYLVANIA (US) | 1999-06-16 | — | — | EP | disclosed |
| US-5856515-A | Electron-deficient porphyrins and processes and intermediates for preparing same | TRUSTEES OF THE UNIVERSITY OF PENNSYLVANIA (US) | 1999-01-05 | — | — | US | disclosed |
| US-5817830-A | Pyrrolic compounds | TRUSTEES OF THE UNIVERSITY OF PENNSYLVANIA (US) | 1998-10-06 | — | — | US | disclosed |
| EP-0821686-A4 | NOVEL PORPHYRINS AND PORPHYRIN SYNTHESIS TECHNIQUES | UNIV PENNSYLVANIA (US) | 1998-04-15 | — | — | EP | disclosed |
| EP-0821686-A1 | NOVEL PORPHYRINS AND PORPHYRIN SYNTHESIS TECHNIQUES | THE TRUSTEES OF THE UNIVERSITY OF PENNSYLVANIA (US) | 1998-02-04 | — | — | EP | disclosed |
| EP-0757690-A1 | ELECTRON-DEFICIENT PORPHYRINS AND PROCESSES AND INTERMEDIATES FOR PREPARING SAME | TRUSTEES OF THE UNIVERSITY OF PENNSYLVANIA (US) | 1997-02-12 | — | — | EP | disclosed |
| US-5599924-A | Electron-deficient porphyrins and processes and intermediates for preparing same | TRUSTEES OF THE UNIVERSITY OF PENNSYLVANIA (US) | 1997-02-04 | — | — | US | disclosed |
| WO-1996017844-A1 | NOVEL PORPHYRINS AND PORPHYRIN SYNTHESIS TECHNIQUES | THE TRUSTEES OF THE UNIVERSITY OF PENNSYLVANIA (US) | 1996-06-13 | — | — | WO | disclosed |
| WO-1995029916-A1 | ELECTRON-DEFICIENT PORPHYRINS AND PROCESSES AND INTERMEDIATES FOR PREPARING SAME | THE TRUSTEES OF THE UNIVERSITY OF PENNSYLVANIA (US) | 1995-11-09 | — | — | WO | disclosed |
| EP-0453398-A2 | Nitroenamine derivatives as pesticides | CIBA-GEIGY AG (CH) | 1991-10-23 | — | — | EP | disclosed |