Cyanate

Cyanate

SCHEMBL3699783

N#CO.O

nearest known ligand 0.00

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

ABCC9ABL1ACEACHEACVR1ADORA1ADORA2AADORA2BADORA3ADRA1AADRA1BADRA1DADRA2AADRA2BADRA2CADRB1ADRB2ADRB3AGTR1ALOX5ATP4AATP4BBCRBTKCACNA1ACACNA1BCACNA1CCACNA1DCACNA1ECACNA1FCACNA1GCACNA1HCACNA1ICACNA1SCACNA2D1CACNA2D2CACNA2D3CACNA2D4CACNB1CACNB2CACNB3CACNB4CACNG1CACNG2CACNG3CACNG4CACNG5CACNG6CACNG7CACNG8CALCRLCFBCHRM1CHRM2CHRM3CHRM4CHRM5CHRNA1CHRNB1CHRNDCHRNECHRNGCRBNCUL4ACXCR1CXCR2DDB1DDCDHFRDPP4DRD2DRD3DRD4EGFRERBB2ERBB4ESR1ESR2FDPSFKBP1AFLT1FLT3FLT4GARTGHSRGRIA1GRIA2GRIA3GRIA4GRIK1GRIK2GRIK3GRIK4GRIK5GRIN2AGSK3AGSK3BHDAC1HDAC10HDAC11HDAC2HDAC3HDAC4HDAC5HDAC6HDAC7HDAC8HDAC9HRH1HTR1AHTR1BHTR1DHTR1EHTR1FHTR2AHTR2BHTR2CHTR3AHTR3BHTR3CHTR3DHTR3EHTR4HTR5AHTR6HTR7IDH1IDH2IMPA1ITGA2BITGB3JAK1JAK2JAK3KCNJ11KCNK3KCNK9KDRKITMEN1METMMP1MMP13MMP7MMP8NANOD2NS5bODC1OPG057OPRD1OPRK1OPRM1PPARP1PARP2PDE3APDE3BPDE4APDE4BPDE4CPDE4DPDGFRBPIK3CAPIK3CBPIK3CDPIK3CGPIK3R1PIK3R2PIK3R3PIK3R5PKLRPPARDPPATPTGS1PTGS2RBX1ROCK1ROCK2RRM1RRM2RRM2BSCN10ASCN11ASCN1ASCN2ASCN3ASCN4ASCN5ASCN7ASCN8ASCN9ASCNN1ASCNN1BSCNN1GSIGMAR1SLC10A2SLC5A2SLC6A2SLC6A3SLC6A4SLC9A3SYKTACR1THRATHRBTOP1TUBA1ATUBA1BTUBA1CTUBA3CTUBA3ETUBA4ATUBBTUBB1TUBB2ATUBB2BTUBB3TUBB4ATUBB4BTUBB6TUBB8TYK2TYMSVDRampCblablaT-3blaT-4blaT-5blaT-6blaUOE-1dacAdacBdacCfolAfolPftsIgyrAgyrBileSmecAmrcAmrcBmrdAparCparEpbp2pbp4pbpApbpFrplArplBrplCrplDrplErplFrplIrplJrplKrplLrplMrplNrplOrplPrplQrplRrplSrplTrplUrplVrplWrplXrplYrpmArpmBrpmCrpmDrpmErpmE2rpmFrpmGrpmG1rpmG2rpmG3rpmHrpmIrpmJrpsArpsBrpsCrpsDrpsErpsFrpsGrpsHrpsIrpsJrpsKrpsLrpsMrpsNrpsOrpsPrpsQrpsRrpsSrpsTrpsUthyAykgMykgO

The experimentally established mechanism targets of Cyanate. 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
Cyanate SCHEMBL11311543 1.00
Cyanate SCHEMBL476210 1.00
Cyanate SCHEMBL5794390 1.00
Cyanate SCHEMBL19680 1.00
Cyanate SCHEMBL9247034 1.00 CA1 (1.00)
Cyanate SCHEMBL11556897 0.93
Cyanate SCHEMBL11556277 0.93
Cyanate SCHEMBL6829237 0.93
Cyanate SCHEMBL10697696 0.93
Cyanate SCHEMBL21810698 0.93

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-112279910-B Hemoglobin preservation solution, application, detection method and fecal preservation device 广州沣润生物科技有限公司 2024-06-21 CN disclosed
CN-117460797-A Pretreatment formulation for digital printing 努尔墨水创新有限公司 2024-01-26 CN disclosed
CN-115956003-A mRNA therapeutic nanoparticles 胡桃钳医疗公司 2023-04-11 CN disclosed
CN-104448822-B Modified cyanate ester resin and preparation method thereof 苏州大学 2017-02-22 CN disclosed
US-9543385-B2 Heavily doped semiconductor nanoparticles YISSUM RESEARCH DEVELOPMENT COMPANY OF THE HEBREW UNIVERSITY OF JERUSALEM LTD. (IL) 2017-01-10 US disclosed
EP-2197825-B1 METHOD OF PRODUCING TERTIARY AMYL ETHYL ETHER CATALYTIC DISTILLATION TECH (US) 2015-11-04 EP disclosed
US-20130299772-A1 HEAVILY DOPED SEMICONDUCTOR NANOPARTICLES RAMOT AT TEL-AVIV UNIVERSITY LTD. (IL) 2013-11-14 US disclosed
WO-2012111009-A2 HEAVILY DOPED SEMICONDUCTOR NANOPARTICLES YISSUM RESEARCH DEVELOPMENT COMPANY OF THE HEBREW UNIVERSITY OF JERUSALEM LTD. (IL) 2012-08-23 WO disclosed
EP-2197825-A2 METHOD OF PRODUCING TERTIARY AMYL ETHYL ETHER Catalytic Distillation Technologies (US) 2010-06-23 EP disclosed
US-7553995-B2 Method of producing tertiary amyl ethyl ether CATALYTIC DISTILLATION TECHNOLOGIES (US) 2009-06-30 US disclosed
WO-2009035844-A2 METHOD OF PRODUCING TERTIARY AMYL ETHYL ETHER CATALYTIC DISTILLATION TECHNOLOGIES (US) 2009-03-19 WO disclosed
US-20090069608-A1 METHOD OF PRODUCING TERTIARY AMYL ETHYL ETHER CATALYTIC DISTILLATION TECHNOLOGIES 2009-03-12 US disclosed
US-4518761-A Process for the preparation of mixed trimers from organic isocyanates, the mixed trimers obtained according to the process and the use thereof for the production of polyurethanes BAYER AKTIENGESELLSCHAFT (DE) 1985-05-21 US disclosed