SCHEMBL1828112

SCHEMBL1828112

[CH2]C(O)CNC(C)=O

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
SCHEMBL10840027 0.83 MTNR1A (0.35)
SCHEMBL1828739 0.80 KDM4E (0.37)
SCHEMBL294912 0.79
SCHEMBL9759569 0.78 TGFBR1 (0.39)
SCHEMBL13411703 0.78 KDM4E (0.43)
SCHEMBL1866034 0.78 KDM4E (0.43)
SCHEMBL7826230 0.78
SCHEMBL1866035 0.78 KDM4E (0.43)
SCHEMBL10311744 0.76
SCHEMBL983886 0.76

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-102766183-A Anti-HIV-1 fusion activity-modified nucleic acid structure INST PHARM & TOXICOLOGY AMMS 2012-11-07 CN claimed
CN-102766183-B There is the nucleic acid structure of the modification of anti-HIV-1 fusion activity 中国人民解放军军事医学科学院毒物药物研究所 2016-09-14 CN disclosed
US-8735387-B2 Oxazolopyrimidines as Edg-1 receptor agonists SANOFI (FR) 2014-05-27 US disclosed
CN-102159582-B Oxazolopyrimidines as edg-1 receptor agonists SANOFI AVENTIS 2014-05-07 CN disclosed
EP-2583720-A1 Oxazolopyrimidines as Edg-1 receptor agonists SANOFI (FR) 2013-04-24 EP disclosed
CN-102766183-A Anti-HIV-1 fusion activity-modified nucleic acid structure INST PHARM & TOXICOLOGY AMMS 2012-11-07 CN disclosed
CN-102159582-A Oxazolopyrimidines as edg-1 receptor agonists SANOFI AVENTIS 2011-08-17 CN disclosed
US-20110190490-A1 OXAZOLOPYRIMIDINES AS EDG-1 RECEPTOR AGONISTS SANOFI-AVENTIS (FR) 2011-08-04 US disclosed
EP-2318415-A1 OXAZOLOPYRIMIDINES AS EDG-1 RECEPTOR AGONISTS Sanofi-Aventis (FR) 2011-05-11 EP disclosed
WO-2010049731-A1 PYRAZOLO- AND IMIDAZOPYRIDINYLPYRIMIDINEAMINES AS IGF-1R TYROSINE KINASE INHIBITORS ASTRAZENECA AB (SE) 2010-05-06 WO disclosed
WO-2010006704-A1 OXAZOLOPYRIMIDINES AS EDG-1 RECEPTOR AGONISTS SANOFI-AVENTIS (FR) 2010-01-21 WO disclosed