SCHEMBL587066

SCHEMBL587066

O=C([O-])S.[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
SCHEMBL11355415 0.89
Lithium Ion SCHEMBL11341699 0.89
SCHEMBL11345606 0.89
Potassium Ion SCHEMBL10454271 0.89
SCHEMBL11355412 0.89 CA4 (0.42)
SCHEMBL9309244 0.89
SCHEMBL10345756 0.89 CA4 (0.42)
Zinc Ion SCHEMBL1907848 0.89
SCHEMBL11346002 0.89
SCHEMBL11348614 0.89

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-110035829-A Inhibitor combination and for during the flotation of sulfide ore inhibit gangue sulphide mineral method 塞特工业公司 2019-07-19 CN claimed
US-4189505-A Pork-like flavorant and process for preparing same SOCIETE D'ASSISTANCE TECHNIQUE POUR PRODUITS NESTLE S.A. (CH) 1980-02-19 US claimed
CN-122103198-A Preparation method of thiocarboxylate silane coupling agent 2026-05-29 CN disclosed
US-20260070068-A1 AMMONIATED POLYCARBAMIDE SEPARATION AIDS FOR MINERAL FLOTATION HEXION INC. (US) 2026-03-12 US disclosed
CN-119798307-A Preparation method of thiocarboxylate silane 万华化学集团股份有限公司 2025-04-11 CN disclosed
CN-117924347-A Preparation method of monosulfur organosilane coupling agent 江西宏柏新材料股份有限公司 2024-04-26 CN disclosed
CN-114570186-B Environment-friendly treatment method for tail gas produced by sulfur-containing silane coupling agent 南京曙光精细化工有限公司 2023-05-12 CN disclosed
US-20220363873-A1 SILANE COUPLING AGENT COMPOSITION COMPRISING SILANE COMPOUND AND PROTEIN MODIFYING AGENT, AND RUBBER COMPOSITION COMPRISING THE SAME ENEOS CORPORATION (JP) 2022-11-17 US disclosed
CN-114570186-A Environment-friendly treatment method for tail gas generated in production of sulfur-containing silane coupling agent 南京曙光精细化工有限公司 2022-06-03 CN disclosed
EP-3981610-A1 SILANE COUPLING AGENT COMPOSITION CONTAINING SILANE COMPOUND AND PROTEIN DENATURING AGENT, AND RUBBER COMPOSITION CONTAINING SAID COMPOSITION ENEOS Corporation (JP) 2022-04-13 EP disclosed
CN-113924335-A Silane coupling agent composition comprising silane compound and protein denaturing agent, and rubber composition comprising same 引能仕株式会社 2022-01-11 CN disclosed
EP-0958298-A1 BLOCKED MERCAPTOSILANE COUPLING AGENTS FOR FILLED RUBBERS WITCO CORPORATION (US) 1999-11-24 EP disclosed
WO-1999009036-A1 BLOCKED MERCAPTOSILANE COUPLING AGENTS FOR FILLED RUBBERS OSI SPECIALTIES, INC. (US) 1999-02-25 WO disclosed
EP-0455269-B1 Packing for use in resolution DAICEL CHEM (JP) 1993-11-10 EP disclosed
EP-0318469-B1 PACKING FOR USE IN RESOLUTION DAICEL CHEMICAL INDUSTRIES, LTD. (JP) 1992-06-10 EP disclosed
EP-0455269-A1 Packing for use in resolution DAICEL CHEMICAL INDUSTRIES, LTD. (JP) 1991-11-06 EP disclosed
EP-0150221-B1 PACKING FOR USE IN SEPARATION DAICEL CHEMICAL INDUSTRIES, LTD. (JP) 1990-08-08 EP disclosed
EP-0318469-A1 Packing for use in resolution DAICEL CHEMICAL INDUSTRIES, LTD. (JP) 1989-05-31 EP disclosed
US-4619984-A MODIFIED SILICA GEL DAICEL CHEMICAL INDUSTRIES, LTD. (JP) 1986-10-28 US disclosed
EP-0150221-A1 PACKING FOR USE IN SEPARATION DAICEL CHEMICAL INDUSTRIES, LTD. (JP) 1985-08-07 EP disclosed