SCHEMBL4581876

SCHEMBL4581876

CC([C]=O)=CO

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
SCHEMBL26535 0.74
SCHEMBL263323 0.74
SCHEMBL1578643 0.74
SCHEMBL713956 0.69
SCHEMBL9841133 0.69
SCHEMBL2771545 0.69
SCHEMBL2889398 0.69
SCHEMBL6801405 0.69
SCHEMBL3693617 0.69
SCHEMBL4654455 0.69

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
JP-57176059-A None JP disclosed
CN-108624142-A Water-based ink for use in ink-jet recording composition and colorant liquid 精工爱普生株式会社 2018-10-09 CN disclosed
CN-108624138-A Water-based ink for use in ink-jet recording composition and colorant liquid 精工爱普生株式会社 2018-10-09 CN disclosed
WO-2008049471-A1 WATER-SOLUBLE HYDROXY-FUNCTIONAL, COPOLYMERIZABLE POLYALKYLENE GLYCOL MACROMONOMERS, THE PRODUCTION AND USE THEREOF CLARIANT INTERNATIONAL LTD. (CH) 2008-05-02 WO disclosed
EP-1916274-A2 Hydroxy-functional, co-polymerisable polyalkyl glycol macro-monomers, their manufacture and utilization Clariant International Ltd. (CH) 2008-04-30 EP disclosed
US-20080097042-A1 Hydroxy-functional copolymerizable polyalkylene glycol macromonomers, their preparation and use CLARIANT INTERNATIONAL LTD. 2008-04-24 US disclosed
JP-S57176059-A POWDERY DEVELOPING TONER FUJITSU LTD 1982-10-29 JP disclosed