SCHEMBL4915772

SCHEMBL4915772

C=CCC(CC=C)C(C)(N=NC(C)(C)C(=O)O)C(=O)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
SCHEMBL185294 0.80 TSHR (0.31)
SCHEMBL185293 0.80 TSHR (0.31)
SCHEMBL6434995 0.74
SCHEMBL6570627 0.74
SCHEMBL10395138 0.72
SCHEMBL1660503 0.72 CA2 (0.40)
SCHEMBL4198189 0.72
SCHEMBL37014 0.71 ALDH1A1 (0.32)
SCHEMBL37013 0.71 ALDH1A1 (0.32)
SCHEMBL186298 0.71 ALDH1A1 (0.32)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0964009-B1 Polymerization of fluoromonomers in carbon dioxide DU PONT (US) 2003-07-30 EP claimed
US-6103844-A USING AN AZO INITIATOR COMPRISING DIALKYL(2,2'-AZOBISISOBUTYRATE) E. I. DU PONT DE NEMOURS AND COMPANY (US) 2000-08-15 US claimed
EP-0964009-A1 Polymerization of fluoromonomers in carbon dioxide E.I. DU PONT DE NEMOURS AND COMPANY (US) 1999-12-15 EP claimed
US-7416707-B2 Polymerization reaction apparatus, and method of producing polymer using this apparatus KANSAI PAINT CO., LTD. (JP) 2008-08-26 US disclosed
US-7091288-B2 Polymerization of vinylidene fluoride (VF2) in a supercritical fluid medium ARKEMA INC. (US) 2006-08-15 US disclosed
US-20060069223-A1 Polymerization of vinylidenefluoride (VF2) in a supercritical fluid medium ARKEMA INC. 2006-03-30 US disclosed
US-20050261450-A1 Polymerization reaction apparatus, and method of producing polymer using this apparatus KANSAI PAINT CO., LTD. (JP) 2005-11-24 US disclosed
EP-0964009-B1 Polymerization of fluoromonomers in carbon dioxide DU PONT (US) 2003-07-30 EP disclosed
US-6103844-A USING AN AZO INITIATOR COMPRISING DIALKYL(2,2'-AZOBISISOBUTYRATE) E. I. DU PONT DE NEMOURS AND COMPANY (US) 2000-08-15 US disclosed
US-6103844-A USING AN AZO INITIATOR COMPRISING DIALKYL(2,2'-AZOBISISOBUTYRATE) E. I. DU PONT DE NEMOURS AND COMPANY (US) 2000-08-15 US disclosed
EP-0964009-A1 Polymerization of fluoromonomers in carbon dioxide E.I. DU PONT DE NEMOURS AND COMPANY (US) 1999-12-15 EP disclosed
EP-0964009-A1 Polymerization of fluoromonomers in carbon dioxide E.I. DU PONT DE NEMOURS AND COMPANY (US) 1999-12-15 EP disclosed