SCHEMBL510236

SCHEMBL510236

NC(=O)CS(=O)(=O)[O-].[Na+]

nearest known ligand 0.00

Known targets — ChEMBL curated mechanism

ABCC8ACEADORA1ADORA2AADORA2BADORA3ALDH5A1ALOX5ALOX5APATP4AATP4BBRAFCA1CA12CA2CA4CYSLTR1DHFRDPEP1EDNRAEDNRBESR2F10FDPSFGF1GABBR1GABBR2GABRA1GABRA2GABRA3GABRA4GABRA5GABRA6GABRB1GABRB2GABRB3GABRDGABREGABRG1GABRG2GABRG3GABRPGABRQGARTGNRHRGSC1HMGCRIMPDH1IMPDH2KCNJ11LY96NOD2NR3C1NS3NS4ANS5bP2RY1P2RY12P2RY2P2RY4P2RY6PBP2XPDE3APDE3BPDE4APDE4BPDE4CPDE4DPDK1PDK2PDK3PDK4PPARGPPATPTGIRPTGS1PTGS2RAF1RYR1RYR3SCN10ASCN11ASCN1ASCN2ASCN3ASCN4ASCN5ASCN7ASCN8ASCN9ASERPINC1SLC12A1SLC12A3SYKTHRATHRBTLR3TLR4TLR9TUBA1ATUBA1BTUBA1CTUBA3CTUBA3ETUBA4ATUBBTUBB1TUBB2ATUBB2BTUBB3TUBB4ATUBB4BTUBB6TUBB8TYMSVKORC1XDHblablaIMP-1blaOXA-33blaOXA-58blaT-3blaT-4blaT-5blaT-6dacAdacBdacCfolAfolPfolP1ftsIfusAgaggyrAgyrBmecAmrcAmrcBmrdApbp1apbp1bpbp2pbp2apbp2bpbp3pbp4pbpApbpBpbpCpbpFpolponBrplArplBrplCrplDrplErplFrplJrplKrplLrplMrplNrplOrplPrplQrplRrplSrplTrplUrplVrplWrplXrplYrpmArpmBrpmCrpmDrpmErpmFrpmGrpmHrpmIrpmJrpoArpoBrpoCrpoZrpsArpsBrpsCrpsDrpsErpsFrpsGrpsHrpsIrpsJrpsKrpsLrpsMrpsNrpsOrpsPrpsQrpsRrpsSrpsTrpsUykgMykgO

The experimentally established mechanism targets of None. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.

⚠ Novel chemotype — no close known analogue (best Tanimoto < 0.3). Unexplored chemical space relative to ChEMBL.

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
Potassium Ion SCHEMBL1760258 0.94 ALDH1A1 (0.40)
Potassium Ion SCHEMBL187046 0.94
SCHEMBL27801973 0.73
SCHEMBL28061984 0.73 POLB (0.53)
SCHEMBL6115235 0.73 CA4 (0.42)
Sulfuric Acid SCHEMBL28356817 0.73 TP53 (0.43)
SCHEMBL11335835 0.72 ALDH1A1 (0.44)
SCHEMBL2348801 0.71 POLB (0.50)
SCHEMBL7191300 0.71
Sulfuric Acid SCHEMBL29052311 0.70 ALDH1A1 (0.50)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-114096339-B Removal of preservatives from eye drops 特清公司 2024-04-12 CN disclosed
CN-116392389-A Removal of preservatives from eye drops containing hydrophilic drugs 佛罗里达大学研究基金会股份有限公司 2023-07-07 CN disclosed
CN-115969774-A Gel system containing ionic liquid and application thereof 中国药科大学 2023-04-18 CN disclosed
US-20230024972-A1 BAKUCHINOYL RETINOATE AND METHODS OF USE THEREOF PHYTO TECH CORP D/B/A/ BLUE CALIFORNIA CO (US) 2023-01-26 US disclosed
CN-111132640-B Removal of preservative from eye drops containing hydrophilic drug 佛罗里达大学研究基金会股份有限公司 2023-01-10 CN disclosed
WO-2022266493-A1 BAKUCHINOYL RETINOATE AND METHODS OF USE THEREOF PHYTO TECH CORP D/B/A/ BLUE CALIFORNIA CO (US) 2022-12-22 WO disclosed
US-20220354952-A1 PHOTODYNAMIC THERAPY METHOD FOR SKIN DISORDERS DUSA PHARMACEUTICALS, INC. (US) 2022-11-10 US disclosed
CN-114392040-A Systems and methods for delivering therapeutic agents 特清公司 2022-04-26 CN disclosed
CN-107073169-B Composite material for tissue repair 约翰·霍普金斯大学技术创业公司 2022-03-08 CN disclosed
CN-114096339-A Removal of preservatives from eye drops 特清公司 2022-02-25 CN disclosed
EP-1011630-A1 CLEANSING AND CONDITIONING ARTICLE FOR SKIN OR HAIR THE PROCTER & GAMBLE COMPANY (US) 2000-06-28 EP disclosed
WO-2000015240-A1 ANIONIC OR CATIONIC DENDRIMER ANTIMICROBIAL OR ANTIPARASITIC COMPOSITIONS STARPHARMA LIMITED (AU) 2000-03-23 WO disclosed
WO-2000015239-A1 INHIBITION OF TOXIC MATERIALS OR SUBSTANCES USING DENDRIMERS STARPHARMA LIMITED (AU) 2000-03-23 WO disclosed
WO-1999055303-A1 CLEANSING ARTICLES FOR SKIN AND/OR HAIR WHICH ALSO DEPOSITS SKIN CARE ACTIVES THE PROCTER & GAMBLE COMPANY (US) 1999-11-04 WO disclosed
EP-0927217-A1 ANGIOGENIC INHIBITORY COMPOUNDS BIOMOLECULAR RESEARCH INSTITUTE LTD. (AU) 1999-07-07 EP disclosed
WO-1999013861-A1 CLEANSING AND CONDITIONING ARTICLE FOR SKIN OR HAIR THE PROCTER & GAMBLE COMPANY (US) 1999-03-25 WO disclosed
WO-1998003573-A1 ANGIOGENIC INHIBITORY COMPOUNDS BIOMOLECULAR RESEARCH INSTITUTE LTD. (AU) 1998-01-29 WO disclosed
EP-0765357-A4 ANTIVIRAL DENDRIMERS BIOMOLECULAR RES INST LTD (AU) 1997-07-30 EP disclosed
EP-0765357-A1 ANTIVIRAL DENDRIMERS BIOMOLECULAR RESEARCH INSTITUTE LTD. (AU) 1997-04-02 EP disclosed
WO-1995034595-A1 ANTIVIRAL DENDRIMERS BIOMOLECULAR RESEARCH INSTITUTE LTD. (AU) 1995-12-21 WO disclosed