SCHEMBL7960658

SCHEMBL7960658

CCCC(=O)OCC.[NaH]

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
SCHEMBL17449766 0.97
SCHEMBL10901590 0.97 ALDH1A1 (0.60)
SCHEMBL6115 0.97
SCHEMBL1866106 0.97 ALDH1A1 (0.60)
SCHEMBL23930216 0.94
SCHEMBL11727701 0.94
SCHEMBL22288371 0.94
Calcium SCHEMBL9066170 0.94
SCHEMBL5902748 0.94
SCHEMBL1506847 0.94

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0001024-B1 CRYSTALLINE FORM OF THE SODIUM SALT OF AN OXYIMINO DERIVATIVE OF THE 7-AMINOTHIAZOLYLACETAMIDO-CEPHALOSPORANIC ACID, PROCESS FOR ITS PREPARATION AND PHARMACEUTICAL COMPOSITIONS CONTAINING IT ROUSSEL-UCLAF (FR) 1981-01-21 EP claimed
WO-2019175761-A1 READY TO USE DANTROLENE COMPOSITIONS ORBICULAR PHARMACEUTICAL TECHNOLOGIES PRIVATE LIMITED (IN) 2019-09-19 WO disclosed
CN-104177296-B Preparation method of 4-(1-hydroxy-1-methyl ethyl)-2-propyl-1H-imidazole-5-carboxylic acid ethyl ester 蒋军荣 2017-01-11 CN disclosed
CN-101087764-A Substituted 5-oxo pyrazoles and [1,2,4]triazoles as antiviral agents SCHERING CORP (US) 2007-12-12 CN disclosed
US-6313305-B1 ANTIBIOTICS, BACTERICIDES HOECHST MARION ROUSSEL (FR) 2001-11-06 US disclosed
US-5936083-A BACTERICIDES Uclaf, Roussel (FR) 1999-08-10 US disclosed
US-5883248-A QUATERNARY AMMONIUM INTERMEDIATES ROUSSEL UCLAF (FR) 1999-03-16 US disclosed
US-5763617-A Cephalosporins ROUSSEL UCLAF (FR) 1998-06-09 US disclosed
US-5728828-A A 3-(3-CHLORO- OR IODOPROP-1-EN-1-YL),7-(2-AMINOTHIAZOL-4-YL) ((CARBOXY)(PHENYL)METHOXYIMINO)ACETAMIDO-3-CEPHEM; GRAMNEGATIVE AND -POSITIVE BACTERIA, ESP. ANTIBIOTIC-RESISTANCE STAPHYLOCOCCUS ROUSSEL UCLAF (FR) 1998-03-17 US disclosed
US-5712266-A Cephalosporins ROUSSEL UCLAF (FR) 1998-01-27 US disclosed
US-5587372-A BACERICIDES ROUSSEL UCLAF (FR) 1996-12-24 US disclosed
US-5541318-A Cephalosporins ROUSSEL UCLAF (FR) 1996-07-30 US disclosed
US-5538963-A BACTERICIDE ANTIBIOTICS ROUSSEL UCLAF (FR) 1996-07-23 US disclosed
US-5455238-A Bactericides ROUSSEL UCLAF (FR) 1995-10-03 US disclosed
US-5416080-A Cephalosporins ROUSSEL-UCLAF (FR) 1995-05-16 US disclosed
US-5397779-A Cephalosporins ROUSSEL-UCLAF (FR) 1995-03-14 US disclosed
US-5378697-A BACTERICIDES ROUSSEL-UCLAF (FR) 1995-01-03 US disclosed
US-5373001-A Antibiotics ROUSSEL UCLAF (FR) 1994-12-13 US disclosed
US-5057512-A Bactericides Uclaf, Roussel (FR) 1991-10-15 US disclosed
US-4900728-A ANTIBIOTICS ROUSSEL UCLAF (FR) 1990-02-13 US disclosed