SCHEMBL5507573

SCHEMBL5507573

[CH2]COC(C)C#N

nearest known ligand 0.00

⚠ 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
SCHEMBL11325833 0.77 TSHR (0.39)
SCHEMBL16768480 0.77 TSHR (0.39)
SCHEMBL319872 0.74
SCHEMBL11191983 0.74
SCHEMBL1015704 0.72
SCHEMBL10947422 0.72
SCHEMBL30880451 0.72
SCHEMBL9229180 0.72 TSHR (0.35)
SCHEMBL6860640 0.72
SCHEMBL5175685 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 44 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11932666-B2 Polymerizable compound, compound, and method for producing boranophosphate oligomer TOKYO UNIVERSITY OF SCIENCE FOUNDATION (JP) 2024-03-19 US claimed
EP-4168409-A1 VMAT2 INHIBITORS AND METHODS OF USE Neurocrine Biosciences, Inc. (US) 2023-04-26 EP claimed
US-20230108357-A1 Polymerizable Compound, Compound, and Method for Producing Boranophosphate Oligomer TOKYO UNIVERSITY OF SCIENCE FOUNDATION (JP) 2023-04-06 US claimed
EP-2921499-B1 METHOD FOR LIQUID-PHASE SYNTHESIS OF NUCLEIC ACIDS TAKEDA PHARMACEUTICALS CO (JP) 2020-01-22 EP claimed
EP-4349846-A1 CHIMERIC NUCLEIC ACID OLIGOMER INCLUDING PHOSPHOROTHIOATE AND BORANOPHOSPHATE, AND METHOD FOR PRODUCING SAME TOKYO UNIVERSITY OF SCIENCE FOUNDATION (JP) 2024-04-10 EP disclosed
US-11932666-B2 Polymerizable compound, compound, and method for producing boranophosphate oligomer TOKYO UNIVERSITY OF SCIENCE FOUNDATION (JP) 2024-03-19 US disclosed
US-11932666-B2 Polymerizable compound, compound, and method for producing boranophosphate oligomer TOKYO UNIVERSITY OF SCIENCE FOUNDATION (JP) 2024-03-19 US disclosed
US-20240010647-A1 SUBSTITUTED PYRIDO[2,1-a]ISOQUINOLINES AS VMAT2 INHIBITORS NEUROCRINE BIOSCIENCES, INC. 2024-01-11 US disclosed
EP-3643706-B1 MODIFIED NUCLEIC ACID MONOMERS AND OLIGONUCLEIC ACID ANALOGUES, WITH HIGH BIOLOGICAL STABILITY AND TARGET GENE SILENCING ACTIVITY, FOR USE IN THERAPY AND DIAGNOSIS OF CANCER AND VIRAL DISEASES EISAI R&D MAN CO LTD (JP) 2023-11-15 EP disclosed
US-11718618-B2 Substituted pyrido[2,1-a]isoquinolines as VMAT2 inhibitors NEUROCRINE BIOSCIENCES, INC. (US) 2023-08-08 US disclosed
US-20230159528-A1 VMAT2 INHIBITORS AND METHODS OF USE NEUROCRINE BIOSCIENCES, INC. 2023-05-25 US disclosed
EP-4168409-A1 VMAT2 INHIBITORS AND METHODS OF USE Neurocrine Biosciences, Inc. (US) 2023-04-26 EP disclosed
EP-1735385-B1 HIGHLY FADEPROOF INKS USED FOR DIGITAL TEXTILE PRINTING DYSTAR TEXTILFARBEN GMBH & CO (DE) 2007-08-08 EP disclosed
EP-1735385-A1 HIGHLY FADEPROOF INKS USED FOR DIGITAL TEXTILE PRINTING DyStar Textilfarben GmbH &amp; Co. Deutschland KG (DE) 2006-12-27 EP disclosed
WO-2005097913-A1 HIGHLY FADEPROOF INKS USED FOR DIGITAL TEXTILE PRINTING DYSTAR TEXTILFARBEN GMBH & CO. DEUTSCHLAND KG (DE) 2005-10-20 WO disclosed
EP-0684289-B1 Thiazol isoindolenine dyes DYSTAR TEXTILFARBEN GMBH & CO (DE) 2001-10-10 EP disclosed
US-5646290-A THERMAL TRANSFER PRINTING; SYNTHETIC FIBERS BAYER AKTIENGESELLSCHAFT (DE) 1997-07-08 US disclosed
EP-0684289-A1 Thiazol isoindolenine dyes BAYER AG (DE) 1995-11-29 EP disclosed
US-4107122-A Copolymer plasticizers comprising novel ω-bromoalkyl esters of acyclic unsaturated dicarboxylic acids MONSANTO COMPANY (US) 1978-08-15 US disclosed
US-4058658-A Copolymers of ω-bromoalkyl esters of acyclic unsaturated dicarboxylic acids MONSANTO COMPANY (US) 1977-11-15 US disclosed