Water

Water

SCHEMBL29435474

O.O.O=C([O-])c1cc([O-])c(C(=O)[O-])cc1[O-].[Co+2].[Co+2]

nearest known ligand 0.36

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 8)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 2/20 0.36
▸ ALDH1A1 P00352 1/20 0.36
▸ HPGD P15428 1/20 0.36
▸ POLB P06746 1/20 0.35
▸ TDP1 Q9NUW8 1/20 0.35
▸ CA1 P00915 3/20 0.32
▸ CA2 P00918 3/20 0.32
▸ CA4 P22748 2/20 0.32

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
SCHEMBL22206250 0.92 KDM4E (0.37) KDM4EALDH1A1HPGDPOLBTDP1
Pyromellitic Acid SCHEMBL22463123 0.73 KDM4E (0.40) KDM4EALDH1A1HPGDPOLBTDP1
SCHEMBL22206255 0.70 KDM4E (0.39) KDM4EALDH1A1HPGDPOLBTDP1
Pyromellitic Acid SCHEMBL9693112 0.69 KDM4E (0.42) KDM4EALDH1A1HPGDPOLBTDP1
Pyromellitic Acid SCHEMBL1881547 0.69 KDM4E (0.42) KDM4EALDH1A1HPGDPOLBTDP1
Pyromellitic Acid SCHEMBL7732128 0.69 KDM4E (0.42) KDM4EALDH1A1HPGDPOLBTDP1
Pyromellitic Acid SCHEMBL1150971 0.69 KDM4E (0.42) KDM4EALDH1A1HPGDPOLBTDP1
Pyromellitic Acid SCHEMBL10454935 0.69 KDM4E (0.42) KDM4EALDH1A1HPGDPOLBTDP1
Pyromellitic Acid SCHEMBL22463129 0.69 KDM4E (0.42) KDM4EALDH1A1HPGDPOLBTDP1
Pyromellitic Acid SCHEMBL6263960 0.69 KDM4E (0.48) KDM4EALDH1A1HPGDPOLBTDP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-122025666-A Multi-scale gradient coupling proton exchange membrane fuel cell catalytic layer water retaining structure and preparation method thereof 常州氢龙科技有限公司 2026-05-12 — — CN claimed
WO-2026090101-A2 ELECTROCHEMICAL CAPACITIVE BIOFOULING RESISTANT BIOSENSORS AND METHODS OF MAKING AND USING SAME WASHINGTON UNIVERSITY (US) 2026-04-30 — — WO claimed
EP-4721855-A1 POLYMERIC FIBER COMPOSITES COMPRISING METAL-ORGANIC FRAMEWORKS AND USE THEREOF Techzero Buildings, S.A. (PT) 2026-04-08 — — EP claimed
US-20260091339-A1 POLYMERYC FIBER COMPOSITES COMPRISING METAL-ORGANIC FRAMEWORKS AND USE THEREOF TECHZERO BUILDINGS S A (PT) 2026-04-02 — — US claimed
CN-120054538-A NiCo-S/NiCo-OH-CL dual-function catalyst with heterostructure and preparation method thereof 湖北大学 2025-05-30 — — CN claimed
CN-119900052-A Electrocatalytic material of MOF (metal oxide fiber) encapsulated polyoxometallate for glycerol oxidation and preparation method thereof 上海理工大学 2025-04-29 — — CN claimed
CN-119725440-A MOF-derived bimetallic selenide embedded nitrogen-doped carbon composite material and preparation method and application thereof 合肥工业大学 2025-03-28 — — CN claimed
CN-116040607-B Porous carbon hybrid material with double-layer hollow core-shell structure, and preparation method and application thereof 合肥工业大学 2025-03-07 — — CN claimed
CN-119219937-A Preparation method and application of MOF-74 with hollow structure 中国科学院上海应用物理研究所 2024-12-31 — — CN claimed
CN-119140113-A Three-dimensional core-shell hydrangea MnOX@Co3O4Preparation method and application of catalyst 嘉应学院 2024-12-17 — — CN claimed
CN-114522688-A Porous carbon loaded bimetallic catalyst and preparation and application thereof 中国科学院大连化学物理研究所 2022-05-24 — — CN claimed
CN-113061264-B Chiral MOFs material and application thereof as chromatographic stationary phase in chiral drug resolution 郑州大学 2022-05-17 — — CN claimed
CN-114478167-A Method and system for recovering refinery dry gas by using metal organic framework material 中国石油化工股份有限公司 2022-05-13 — — CN claimed
CN-114497828-A Fusiform Ag/Co3O4Composite material, preparation method thereof and application thereof in lithium air battery 合肥国轩高科动力能源有限公司 2022-05-13 — — CN claimed
CN-114478173-A Method, system and application for recovering refinery dry gas 中国石油化工股份有限公司 2022-05-13 — — CN claimed
CN-113174143-B Metal organic framework/multilayer carbon composite wave-absorbing material and preparation method thereof 鲁东大学 2022-05-10 — — CN claimed
CN-114452842-A CNC/Cu-MOF-74 composite material surface modified PVDF membrane, and preparation method and application thereof 上海电力大学 2022-05-10 — — CN claimed
CN-110161100-B Preparation method of label-free electrochemical sensor for cardiac troponin I and detection method for cTnI 闽南师范大学 2022-04-08 — — CN claimed
CN-114225910-A Aminated modified Co-MOFs material with NO adsorption separation performance 桂林理工大学 2022-03-25 — — CN claimed
CN-114133582-A Preparation of three-dimensional structure Co-MOF-74 material and application of VOCs (volatile organic Compounds) of material 桂林理工大学 2022-03-04 — — CN 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-20260091339-A1 POLYMERYC FIBER COMPOSITES COMPRISING METAL-ORGANIC FRAMEWORKS AND USE THEREOF PUF60, MT-CO2, MIF KDM4E 2111/4885ALDH1A1 1444/4885HPGD 2075/4885

“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.

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