SCHEMBL27474685

SCHEMBL27474685

[CH2]CCC(=N)C(=O)CC

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
SCHEMBL27760036 0.79
SCHEMBL27478534 0.79
SCHEMBL27950788 0.75
SCHEMBL27892113 0.75 EGLN1 (0.45)
SCHEMBL27606015 0.73 CAMK2A (0.40)
SCHEMBL28796526 0.71 SLC22A6 (0.50)
SCHEMBL27604492 0.71 AKR1B1 (0.52)
SCHEMBL22972019 0.69
SCHEMBL21753651 0.68
SCHEMBL5181660 0.68

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 40 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-101213192-B Pyrimidine-substituted benzimidazole derivatives as protein kinase inhibitors IRM LLC 2012-06-06 CN claimed
CN-1960988-B Compounds and compositions as protein kinase inhibitors IRM LLC 2012-01-25 CN claimed
CN-102056933-A Thiazolopyridin-2-yloxy-phenyl and thiazolopyrazin-2-yloxy-phenyl amines as modulators of leukotriene A4 hydrolase JANSSEN PHARMACEUTICA NV 2011-05-11 CN claimed
CN-101648947-A 4-(n-phenylamino)-quinazolines / quinolines as tyrosine kinase inhibitors BOEHRINGER INGELHEIM PHARMA DE 2010-02-17 CN claimed
CN-101611005-A Be used as the acetophenones of the replacement of PDE4 inhibitor LEO PHARMA AS (DK) 2009-12-23 CN claimed
CN-100546980-C Benzimidazole derivatives, preparation method and medical application thereof S BIO PTE LTD (SG) 2009-10-07 CN claimed
CN-101316841-A Arylmethylene urea derivative and use thereof TORAY INDUSTRIES (JP) 2008-12-03 CN claimed
CN-101248041-A Sphingosine kinase inhibitors APOGEE BIOTECHNOLOGY CORP (US) 2008-08-20 CN claimed
CN-101213192-A Pyrimidine-substituted benzimidazole derivatives as protein kinase inhibitors IRM LLC (BM) 2008-07-02 CN claimed
CN-100341873-C Pyrido 2,3-d pyrimidin-7-carboxylic acid derivatives, their manufacture and use as pharmaceutical agents HOFFMANN LA ROCHE (CH) 2007-10-10 CN claimed
CN-101031568-A Compounds and compositions as protein kinase inhibitors IRM LLC (BM) 2007-09-05 CN claimed
CN-1960988-A Compounds and compositions as protein kinase inhibitors IRM LLC (BM) 2007-05-09 CN claimed
CN-1860103-A Benzimidazole derivatives, preparation method and medical application thereof S BIO PTE LTD (SG) 2006-11-08 CN claimed
CN-1798734-A Novel compounds and compositions as protein kinase inhibitors IRM LLC (BM) 2006-07-05 CN claimed
CN-1768059-A Pyrido 2,3-d pyrimidin-7-carboxylic acid derivatives, their manufacture and use as pharmaceutical agents HOFFMANN LA ROCHE (CH) 2006-05-03 CN claimed
CN-1174981-C Imidazo [1, 2-A ] pyridine and pyrazolo [2, 3-A ] pyridine derivatives 2004-11-10 CN claimed
CN-101213192-B Pyrimidine-substituted benzimidazole derivatives as protein kinase inhibitors IRM LLC 2012-06-06 CN disclosed
CN-1960988-B Compounds and compositions as protein kinase inhibitors IRM LLC 2012-01-25 CN disclosed
CN-1509274-A Metallo proteinase inhibitors 2004-06-30 CN disclosed
CN-1509275-A Metalloproteinase inhibitors 2004-06-30 CN disclosed