Methane

Methane

SCHEMBL5156813

C.[Na+].[Na+].[O-]S[O-]

nearest known ligand 0.00

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Known targets — ChEMBL curated mechanism

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

The experimentally established mechanism targets of Methane. 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
SCHEMBL781105 0.91
Water SCHEMBL11237264 0.83
Hydrogen Peroxide SCHEMBL8767971 0.77
Hydrogen Peroxide SCHEMBL8767974 0.77
Zinc Ion SCHEMBL1501680 0.73
Formaldehyde SCHEMBL472244 0.72
Formaldehyde SCHEMBL1269631 0.68
Formaldehyde SCHEMBL1857801 0.68
Formaldehyde SCHEMBL9308096 0.65
SCHEMBL7066914 0.62

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 18 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1315774-B1 POLYVINYL CHLORIDE RESINS AND METHOD OF PREPARATION AND USE IN THE PRODUCTION OF WHITENED POLYVINYL CHLORIDE FOAM OCCIDENTAL CHEMICAL CORP OCCID (US) 2007-01-03 EP claimed
US-6608115-B2 Sulfur compounds selected from sulfonic acid derivatives, sulfinic acid derivatives, and mercaptoacetic acid, sodium salt; can optionally contain water soluble salts and/or t-butyl hydroperoxide OCCIDENTAL CHEMICAL CORPORATION 2003-08-19 US claimed
US-6605649-B2 Incorporating both sulfonic acid and sulfinic acid deriva-tives and mercapto acetic acid sodium salt into plastisol and heat expanding OCCIDENTAL CHEMICAL CORPORATION 2003-08-12 US claimed
EP-1315774-A2 POLYVINYL CHLORIDE RESINS AND METHOD OF PREPARATION AND USE IN THE PRODUCTION OF WHITENED POLYVINYL CHLORIDE FOAM OCCIDENTAL CHEMICAL CORPORATION, Occidental Tower (US) 2003-06-04 EP claimed
US-20030100622-A1 Polyvinyl chloride resins and method of preparation and use in the production of whitened polyvinyl chloride foam MORAN MICHAEL T (US) 2003-05-29 US claimed
US-20030100620-A1 Polyvinyl chloride resins and method of preparation and use in the production of whitened polyvinyl chloride foam MORAN MICHAEL T (US) 2003-05-29 US claimed
US-20020056936-A1 Polyvinyl chloride resins and method of preparation and use in the production of whitened polyvinyl chloride foam OCCCIDENTAL CHEMICAL CORPORATIOR 2002-05-16 US claimed
WO-2002020660-A2 POLYVINYL CHLORIDE RESINS AND METHOD OF PREPARATION AND USE IN THE PRODUCTION OF WHITENED POLYVINYL CHLORIDE FOAM OCCIDENTAL CHEMICAL CORPORATION (US) 2002-03-14 WO claimed
EP-1315774-B1 POLYVINYL CHLORIDE RESINS AND METHOD OF PREPARATION AND USE IN THE PRODUCTION OF WHITENED POLYVINYL CHLORIDE FOAM OCCIDENTAL CHEMICAL CORP OCCID (US) 2007-01-03 EP disclosed
US-6608115-B2 Sulfur compounds selected from sulfonic acid derivatives, sulfinic acid derivatives, and mercaptoacetic acid, sodium salt; can optionally contain water soluble salts and/or t-butyl hydroperoxide OCCIDENTAL CHEMICAL CORPORATION 2003-08-19 US disclosed
US-6605649-B2 Incorporating both sulfonic acid and sulfinic acid deriva-tives and mercapto acetic acid sodium salt into plastisol and heat expanding OCCIDENTAL CHEMICAL CORPORATION 2003-08-12 US disclosed
EP-1315774-A2 POLYVINYL CHLORIDE RESINS AND METHOD OF PREPARATION AND USE IN THE PRODUCTION OF WHITENED POLYVINYL CHLORIDE FOAM OCCIDENTAL CHEMICAL CORPORATION, Occidental Tower (US) 2003-06-04 EP disclosed
US-20030100622-A1 Polyvinyl chloride resins and method of preparation and use in the production of whitened polyvinyl chloride foam MORAN MICHAEL T (US) 2003-05-29 US disclosed
US-20030100620-A1 Polyvinyl chloride resins and method of preparation and use in the production of whitened polyvinyl chloride foam MORAN MICHAEL T (US) 2003-05-29 US disclosed
US-6500873-B2 CONTAIN SULFUR COMPOUNDS SELECTED FROM SULFONIC ACID DERIVATIVES, SULFINIC ACID DERIVATIVES, AND MERCAPTO ACETIC ACID SODIUM SALT, AND OPTIONALLY CONTAIN WATER SOLUBLE SALTS AND/OR T-BUTYL HYDROPEROXIDE. OCCIDENTAL CHEMICAL CORPORATION 2002-12-31 US disclosed
US-20020056936-A1 Polyvinyl chloride resins and method of preparation and use in the production of whitened polyvinyl chloride foam OCCCIDENTAL CHEMICAL CORPORATIOR 2002-05-16 US disclosed
WO-2002020660-A2 POLYVINYL CHLORIDE RESINS AND METHOD OF PREPARATION AND USE IN THE PRODUCTION OF WHITENED POLYVINYL CHLORIDE FOAM OCCIDENTAL CHEMICAL CORPORATION (US) 2002-03-14 WO disclosed
US-4598040-A Photographic system and process HANETZ INTERNATIONAL INC., 1986-07-01 US disclosed