SCHEMBL4412906

SCHEMBL4412906

C=[C]NC(=O)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
SCHEMBL3969269 0.77
SCHEMBL371204 0.74
SCHEMBL2590452 0.74
SCHEMBL8079046 0.70
SCHEMBL25369963 0.67 TSHR (0.53)
SCHEMBL9873761 0.67
SCHEMBL7165464 0.67
SCHEMBL26217 0.67
SCHEMBL692572 0.67
SCHEMBL11328913 0.65

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
EP-1545428-B1 PROCESS FOR DECREASING AGGREGATE LEVELS OF PEGYLATED PROTEIN PHARMACIA CORP (US) 2009-12-30 EP disclosed
US-7470779-B2 Process for decreasing aggregate levels of pegylated protein PFIZER INC. (US) 2008-12-30 US disclosed
US-20060157647-A1 Multidimensional liquid chromatography/spectrometry BECTON, DICKINSON AND COMPANY (US) 2006-07-20 US disclosed
EP-1545428-A4 PROCESS FOR DECREASING AGGREGATE LEVELS OF PEGYLATED PROTEIN PHARMACIA CORP (US) 2006-03-01 EP disclosed
EP-1545428-A2 PROCESS FOR DECREASING AGGREGATE LEVELS OF PEGYLATED PROTEIN Pharmacia Corporation (US) 2005-06-29 EP disclosed
US-20050085631-A1 Process for decreasing aggregate levels of pegylated protein PHARMACIA CORPORATION (US) 2005-04-21 US disclosed
WO-2004026251-A2 PROCESS FOR DECREASING AGGREGATE LEVELS OF PEGYLATED PROTEIN PHARMACIA CORPORATION (US) 2004-04-01 WO disclosed