SCHEMBL3732099

SCHEMBL3732099

O=[Si]([O-])[O-].[LiH].[LiH].[MgH2].[MgH2].[Na+].[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
SCHEMBL7176567 0.94
SCHEMBL7543731 0.94
SCHEMBL8777357 0.89
SCHEMBL6092483 0.89
Water SCHEMBL11229475 0.89
Fluoride Ion SCHEMBL13387481 0.89
SCHEMBL9126752 0.88
SCHEMBL9701931 0.88
SCHEMBL9398161 0.88
SCHEMBL26885 0.88

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10240081-B2 Crosslinker composition including synthetic layered silicate ECOLAB USA INC. (US) 2019-03-26 US claimed
EP-3294833-A1 CROSSLINKER COMPOSITION INCLUDING SYNTHETIC LAYERED SILICATE Ecolab USA Inc. (US) 2018-03-21 EP claimed
WO-2016183181-A1 CROSSLINKER COMPOSITION INCLUDING SYNTHETIC LAYERED SILICATE ECOLAB USA INC. (US) 2016-11-17 WO claimed
US-20160333255-A1 CROSSLINKER COMPOSITION INCLUDING SYNTHETIC LAYERED SILICATE NORRISEAL-WELLMARK, INC. 2016-11-17 US claimed
US-20150056304-A1 GEL, IN PARTICULAR FOR USE IN A WOUND TREATMENT AGENT CALIOPA AG (CH) 2015-02-26 US claimed
EP-3860667-A1 GEL, IN PARTICULAR FOR USE IN A WOUND TREATMENT AGENT SANIXTREME GMBH & CO KG (DE) 2021-08-11 EP disclosed
WO-2020069771-A1 GEL, IN PARTICULAR FOR USE IN A WOUND TREATMENT AGENT SANIXTREME GMBH & CO KG (DE) 2020-04-09 WO disclosed
US-10240081-B2 Crosslinker composition including synthetic layered silicate ECOLAB USA INC. (US) 2019-03-26 US disclosed
EP-3294833-A1 CROSSLINKER COMPOSITION INCLUDING SYNTHETIC LAYERED SILICATE Ecolab USA Inc. (US) 2018-03-21 EP disclosed
US-20160333255-A1 CROSSLINKER COMPOSITION INCLUDING SYNTHETIC LAYERED SILICATE NORRISEAL-WELLMARK, INC. 2016-11-17 US disclosed
WO-2016183181-A1 CROSSLINKER COMPOSITION INCLUDING SYNTHETIC LAYERED SILICATE ECOLAB USA INC. (US) 2016-11-17 WO disclosed
US-9320920-B2 Wax-in-water emulsion comprising a combination of a glutamic acid derivative and an alkylpolyglycoside L'OREAL (FR) 2016-04-26 US disclosed
US-20080268003-A1 Aqueous solution containing multilaye rinterference pigments L'OREAL (FR) 2008-10-30 US disclosed
US-20080241086-A1 Line of cosmetic compositions L'OREAL (FR) 2008-10-02 US disclosed
US-20080102046-A1 Cosmetic composition L'OREAL (FR) 2008-05-01 US disclosed
US-7208168-B2 Segmented composition and a method and a system for making same AVON PRODUCTS, INC (US) 2007-04-24 US disclosed
US-20050255136-A1 Segmented composition and a method and a system for making same CITIBANK, N.A., LONDON BRANCH 2005-11-17 US disclosed
EP-1353623-A2 A SEGMENTED COMPOSITION AND A METHOD AND A SYSTEM FOR MAKING SAME AVON PRODUCTS, INC. (US) 2003-10-22 EP disclosed
WO-2002053095-A2 A SEGMENTED COMPOSITION AND A METHOD AND A SYSTEM FOR MAKING SAME AVON PRODUCTS, INC. (US) 2002-07-11 WO disclosed
US-20020085983-A1 Segmented composition and a method and a system for making same AVON PRODUCTS, INC. 2002-07-04 US disclosed