SCHEMBL818650

SCHEMBL818650

C=CC(C)=CC(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
SCHEMBL28807779 0.84 ALDH1A1 (0.33)
SCHEMBL9718000 0.75 ALDH1A1 (0.30)
SCHEMBL24799003 0.75
SCHEMBL9718002 0.75 ALDH1A1 (0.30)
SCHEMBL9768427 0.75 ALDH1A1 (0.30)
Tert-Butanol SCHEMBL8666137 0.71 ALDH1A1 (0.37)
SCHEMBL7945295 0.71
SCHEMBL29585643 0.71
SCHEMBL8840259 0.71
SCHEMBL7945293 0.71

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2370393-B1 A METHYL METHACRYLATE PURIFICATION PROCESS LUCITE INT UK LTD (GB) 2020-02-26 EP disclosed
US-8907121-B2 Methyl methacrylate purification process LUCITE INTERNATIONAL UK LIMITED (GB) 2014-12-09 US disclosed
US-20110282023-A1 METHYL METHACRYLATE PURIFICATION PROCESS LUCITE INTERNATIONAL UK LIMITED (GB) 2011-11-17 US disclosed
EP-2370393-A1 METHYL METHACRYLATE PURIFICATION PROCESS Lucite International UK Limited (GB) 2011-10-05 EP disclosed
WO-2010070325-A1 METHYL METHACRYLATE PURIFICATION PROCESS LUCITE INTERNATIONAL UK LIMITED (GB) 2010-06-24 WO disclosed