SCHEMBL1214744

SCHEMBL1214744

CC(=O)OCC([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
SCHEMBL4688208 0.78 ALDH1A1 (0.53)
SCHEMBL4869307 0.78
SCHEMBL10458150 0.78 ALDH1A1 (0.53)
SCHEMBL10530231 0.78 ALDH1A1 (0.53)
SCHEMBL311876 0.78 ALDH1A1 (0.53)
SCHEMBL36403 0.78
SCHEMBL10530238 0.78 ALDH1A1 (0.53)
Ethane SCHEMBL10598555 0.77 ALDH1A1 (0.46)
SCHEMBL4103921 0.75 ALDH1A1 (0.50)
SCHEMBL8966833 0.75

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7157474-B2 C10 heterosubstituted acetate taxane compositions FSU RESEARCH FOUNDATION, INC. (US) 2007-01-02 US claimed
US-20050143447-A1 C10 heterosubstituted acetate taxane compositions FLORIDA STATE UNIVERSITY RESEARCH FOUNDATION, INC. (US) 2005-06-30 US claimed
US-6872837-B2 Taxanes having a c10 Heterosubstituted acetate substituent FSU RESEARCH FOUNDATION, INC. (US) 2005-03-29 US claimed
US-20040024051-A1 C10 heterosubstituted acetate taxanes FSU RESEARCH FOUNDATION, INC. 2004-02-05 US claimed
EP-0705260-B1 CONDENSED 4-AMINOPYRIDINES WITH ANTIRHEUMATIC ACTIVITY KNOLL AG (DE) 1999-03-03 EP claimed
US-5780482-A TREATING RHEUMATIC DISEASES KNOLL AKTIENGESELLSCHAFT (DE) 1998-07-14 US claimed
EP-0705260-A1 CONDENSED 4-AMINOPYRIDINES WITH ANTIRHEUMATIC ACTIVITY KNOLL AKTIENGESELLSCHAFT (DE) 1996-04-10 EP claimed
WO-1995000511-A1 CONDENSED 4-AMINOPYRIDINES WITH ANTIRHEUMATIC ACTIVITY KNOLL AG (DE) 1995-01-05 WO claimed
WO-2020069353-A1 COMPOUNDS AND COMPOSITIONS FOR OCULAR DELIVERY Graybug Vision, Inc. (US) 2020-04-02 WO disclosed
WO-2019062561-A1 SYNTHESIS METHODS OF FIROCOXIB AND INTERMEDIATE THEREOF SICHUAN QINGMU PHARMACEUTICAL CO., LTD. (CN) 2019-04-04 WO disclosed
US-20110034417-A1 SUBSTITUTED PIPERIDINE COMPOUNDS AND METHODS OF THEIR USE ADOLOR CORPORATION (US) 2011-02-10 US disclosed
EP-1273343-B1 METHOD OF SEPARATING IMIDE COMPOUND DAICEL CHEM (JP) 2010-11-24 EP disclosed
EP-1499649-B1 CATIONIC, AMINO-FUNCTIONAL, ADHESION-PROMOTING POLYMER FOR CURABLE INKS AND OTHER PLASTIC FILM COATINGS, AND PLASTIC FILM COMPRISING SUCH POLYMER EXXONMOBIL OIL CORP (US) 2008-12-24 EP disclosed
US-7285684-B2 Process for separating imide compounds DAICEL CHEMICAL INDUSTRIES, LTD. (JP) 2007-10-23 US disclosed
EP-0342710-A1 Macrolide compounds, their preparation and their use Sankyo Company Limited (JP) 1989-11-23 EP disclosed
EP-0246739-A2 Macrolide compounds, their preparation and their use SANKYO COMPANY LIMITED (JP) 1987-11-25 EP disclosed
US-4560775-A REACTING BUTADIENE AND ACETIC ACID WITH A METAL SALT OXIDANT MONSANTO COMPANY (US) 1985-12-24 US disclosed
US-4545982-A DECOLORING AGENTS YAKURIGAKU CHUO KENKYUSHO (JP) 1985-10-08 US disclosed
US-4321409-A Process for producing conjugated diene monoesters JAPAN SYNTHETIC RUBBER CO., LTD. (JP) 1982-03-23 US disclosed
US-3959256-A BACTERICIDE MEIJI SEIKA KAISHA, LTD. (JA) 1976-05-25 US disclosed