SCHEMBL869931

SCHEMBL869931

CC(C)COP(=O)([S-])SCC(C)C.[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 SCHEMBL4756104 0.96
SCHEMBL4756200 0.77 ALDH1A1 (0.31)
SCHEMBL6780032 0.77 ALDH1A1 (0.31)
SCHEMBL8659098 0.73 CYP3A4 (0.33)
SCHEMBL1691783 0.73
SCHEMBL8073031 0.72
SCHEMBL4756101 0.72
SCHEMBL20556283 0.72
SCHEMBL164021 0.72
SCHEMBL3920781 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 92 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-118950263-A Copper-molybdenum ore flotation collector and preparation method and application thereof 昆明理工大学 2024-11-15 CN claimed
EP-3691992-B1 PROCESSES FOR REMOVING HEAVY METALS FROM PHOSPHORIC ACID SOLUTIONS CYTEC IND INC (US) 2022-07-06 EP claimed
CN-114262086-A Method for recycling stainless steel pickling waste acid 深圳市长隆科技有限公司 2022-04-01 CN claimed
CN-109174434-B Method for separating quartz from low-grade potassium-sodium feldspar ore 贺州市骏鑫矿产品有限责任公司 2021-04-16 CN claimed
US-10865110-B2 Compositions and processes for removing heavy metals from phosphoric acid solutions CYTEC INDUSTRIES INC. (US) 2020-12-15 US claimed
EP-3691992-A2 COMPOSITIONS AND PROCESSES FOR REMOVING HEAVY METALS FROM PHOSPHORIC ACID SOLUTIONS Cytec Industries Inc. (US) 2020-08-12 EP claimed
US-20190106324-A1 COMPOSITIONS AND PROCESSES FOR REMOVING HEAVY METALS FROM PHOSPHORIC ACID SOLUTIONS CYTEC INDUSTRIES INC. (US) 2019-04-11 US claimed
US-20150209801-A1 MONOTHIOPHOSPHATE CONTAINING COLLECTORS AND METHODS TEEBEE HOLDINGS PTY LTD (AU) 2015-07-30 US claimed
WO-2014012139-A1 MONOTHIOPHOSPHATE CONTAINING COLLECTORS AND METHODS TEEBEE HOLDINGS PTY LTD (AU) 2014-01-23 WO claimed
WO-2008037060-A1 METHODS FOR CORROSION CONTROL OF STEEL IN AQUEOUS ENVIRONMENT USING PASSIVE IRON-SULPHUR LAYERS CORRXAN CHEMICALS LTD. (CA) 2008-04-03 WO claimed
WO-2008019451-A1 COLLECTORS AND FLOTATION METHODS AB TALL (HOLDINGS) PTY LTD (AU) 2008-02-21 WO claimed
US-4404022-A Dore slag treatment NORANDA MINES LIMITED (CA) 1983-09-13 US claimed
EP-0079179-A1 Dore slag treatment NORANDA INC. (CA) 1983-05-18 EP claimed
US-4040950-A COPPER SULFIDES AMERICAN CYANAMID COMPANY (US) 1977-08-09 US claimed
EP-4713304-A1 PROCESS FOR UPGRADING METALS PRESENT IN A PHOSPHORIC ACID SOLUTION Université Mohammed VI Polytechnique (MA) 2026-03-25 EP disclosed
CN-118950263-B Copper-molybdenum ore flotation collector and preparation method and application thereof 昆明理工大学 2025-10-14 CN disclosed
EP-4619341-A1 COMPOSITIONS AND PROCESSES FOR REMOVING HEAVY METALS FROM PHOSPHORIC ACID CONTAINING STREAMS Cytec Industries Inc. (US) 2025-09-24 EP disclosed
US-4040950-A COPPER SULFIDES AMERICAN CYANAMID COMPANY (US) 1977-08-09 US disclosed
US-4036746-A COPPER SULFIDE ORES MINEREC CORPORATION (US) 1977-07-19 US disclosed
US-3971836-A FLOTATION PROMOTER MINEREC CORPORATION (US) 1976-07-27 US disclosed