SCHEMBL419996

SCHEMBL419996

CCSC(=S)[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
SCHEMBL11039696 0.94 CA12 (0.35)
Potassium Ion SCHEMBL5656840 0.94
SCHEMBL8513659 0.77
Zinc Ion SCHEMBL10802530 0.75 NOS3 (0.42)
SCHEMBL11227209 0.75 NOS3 (0.42)
SCHEMBL10397109 0.73
SCHEMBL11039346 0.71
SCHEMBL11309327 0.71 TDP1 (0.40)
SCHEMBL35180 0.69
SCHEMBL11605944 0.69 CA12 (0.48)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-118063704-A Graft copolymer, process for producing the same, rubber composition, use and tire 中国石油化工股份有限公司 2024-05-24 CN claimed
US-4435304-A METAL TRITHIOCARBONATJES PHILLIPS PETROLEUM COMPANY (US) 1984-03-06 US claimed
WO-2025050013-A1 COVALENT POLYMER-NUCLEIC ACID CONJUGATES FOR MODULATION OF THE RIG-I PATHWAY VANDERBILT UNIVERSITY (US) 2025-03-06 WO disclosed
US-20240408027-A1 HIGH DRUG LOADING POLYMERS VANDERBILT UNIVERSITY 2024-12-12 US disclosed
US-20240279264-A1 CATALYTIC POLYMERIZATION AND DEPOLYMERIZATION OF 1,6-ANHYDROSUGARS THE TRUSTEES OF BOSTON COLLEGE (US) 2024-08-22 US disclosed
CN-118063704-A Graft copolymer, process for producing the same, rubber composition, use and tire 中国石油化工股份有限公司 2024-05-24 CN disclosed
US-11707483-B2 Micellic assemblies UNIVERSITY OF WASHINGTON (US) 2023-07-25 US disclosed
WO-2023059833-A1 HIGH DRUG LOADING POLYMERS VANDERBILT UNIVERSITY (US) 2023-04-13 WO disclosed
EP-2947116-B1 CHEMICALLY FUNCTIONALIZED RENEWED RUBBER COMPOSITION LEHIGH TECH INC (US) 2023-03-08 EP disclosed
CN-108864455-B Preparation method of photocatalytic anion exchange membrane 安徽大学 2020-10-13 CN disclosed
US-20200147121-A1 MICELLIC ASSEMBLIES UNIVERSITY OF WASHINGTON (US) 2020-05-14 US disclosed
US-6214954-B1 HOMO OR COPOLYMERIZING AN OLEFIN WITH POLYMERIZATION CATALYST COMPRISING A TRANSITION METAL COMPOUND, CYCLOPENTADIENYL RING CONTAINING LIGAND AND A CHELATING LIGAND, PRODUCES POLYMER WITH NARROW MOLECULAR WEIGHT DISTRIBUTION AND UNIFORMITY ASAHI KASEI KOGYO KABUSHIKI KAISHA (JP) 2001-04-10 US disclosed
EP-0798313-B1 OLEFIN POLYMERIZATION CATALYST ASAHI CHEMICAL IND (JP) 2001-03-21 EP disclosed
EP-0798313-A1 OLEFIN POLYMERIZATION CATALYST Asahi Kasei Kogyo Kabushiki Kaisha (JP) 1997-10-01 EP disclosed
US-4534857-A Ore flotation with combined collectors PHILLIPS PETROLEUM COMPANY (US) 1985-08-13 US disclosed
US-4534857-A Ore flotation with combined collectors PHILLIPS PETROLEUM COMPANY (US) 1985-08-13 US disclosed
US-4462898-A MOLYBDENUM VALUES USING AN AQUEOUS SYNERGISTIC MIXTURE OF SODIUM SALTS OF DIETHYLTHIOPHOSPHATE AND ETHYL TRITHIOCARBONATE PHILLIPS PETROLEUM COMPANY (US) 1984-07-31 US disclosed
US-4462898-A MOLYBDENUM VALUES USING AN AQUEOUS SYNERGISTIC MIXTURE OF SODIUM SALTS OF DIETHYLTHIOPHOSPHATE AND ETHYL TRITHIOCARBONATE PHILLIPS PETROLEUM COMPANY (US) 1984-07-31 US disclosed
US-4435304-A METAL TRITHIOCARBONATJES PHILLIPS PETROLEUM COMPANY (US) 1984-03-06 US disclosed
US-3715337-A PREPARATION OF POLY(ISOCYANURATE-URETHANES) USING TRITHIOCARBONATES AS CATALYSTS MINNESOTA MINING & MFG 1973-02-06 US disclosed