SCHEMBL12018477

SCHEMBL12018477

CC(C)(C)CC(N=O)C(C)(C)C

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
SCHEMBL24134585 0.72
SCHEMBL1628667 0.70
SCHEMBL25465108 0.70 ANPEP (0.31)
SCHEMBL20633922 0.67 CA2 (0.37)
SCHEMBL12435545 0.64
SCHEMBL24331919 0.63
SCHEMBL21869022 0.60 TSHR (0.30)
SCHEMBL21884169 0.59
SCHEMBL5310619 0.59
SCHEMBL12018615 0.59

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2568339-A2 Lithographic printing plate precursor and method of manufacturing lithographic printing plate Fujifilm Corporation (JP) 2013-03-13 EP disclosed
EP-2555054-A1 DEVELOPER FOR PROCESSING PLANOGRAPHIC PRINTING PLATE PRECURSOR, METHOD FOR PREPARING PLANOGRAPHIC PRINTING PLATE USING THE DEVELOPER, AND METHOD FOR PRINTING FUJIFILM Corporation (JP) 2013-02-06 EP disclosed
EP-2492752-A1 Lithographic printing plate precursor and plate making method thereof Fujifilm Corporation (JP) 2012-08-29 EP disclosed