SCHEMBL3623299

SCHEMBL3623299

COC(N(C)C)=[N+](C)C.O=P([O-])(C(F)(F)C(F)(F)F)C(F)(F)C(F)(F)F

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
SCHEMBL2248281 0.73
Silver SCHEMBL18668196 0.66 PGK1 (0.30)
Lithium Ion SCHEMBL4017890 0.66 PGK1 (0.30)
SCHEMBL16346604 0.66 PGK1 (0.30)
SCHEMBL15136602 0.66 KDM4E (0.30)
SCHEMBL12469732 0.66 PGK1 (0.30)
SCHEMBL15136323 0.66 PGK1 (0.30)
Potassium Ion SCHEMBL3272040 0.66 SLC34A1 (0.33)
SCHEMBL15230462 0.66
Tetramethylammonium Ion SCHEMBL12469916 0.65

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2820026-B1 PROCESS FOR PRODUCING PHOSPHINIC ACID ESTERS MERCK PATENT GMBH (DE) 2016-01-13 EP disclosed
US-9056881-B2 Process for the preparation of phosphinic acid esters MERCK PATENT GMBH (DE) 2015-06-16 US disclosed
US-20150045572-A1 PROCESS FOR THE PREPARATION OF PHOSPHINIC ACID ESTERS MERCK PATENT GMBH (DE) 2015-02-12 US disclosed
US-8859813-B2 Ionic liquids having uronium cations and a process for making same MERCK PATENT GMBH (DE) 2014-10-14 US disclosed
EP-1628952-B1 IONIC LIQUID COMPRISING URONIUM CATIONS OR THIOURONIUM CATIONS MERCK PATENT GMBH (DE) 2014-09-03 EP disclosed
US-20120316058-A1 IONIC LIQUIDS HAVING URONIUM OF THIOURONIUM CATIONS MERCK PATENT GMBH (DE) 2012-12-13 US disclosed
US-8269041-B2 Ionic liquids having uronium or thiouronium cations Merl Patent GmbH (DE) 2012-09-18 US disclosed
EP-1685095-B1 METHOD FOR THE PRODUCTION OF ORGANIC SALTS CONTAINING BIS(PERFLUOROALKYL)PHOSPHINATE ANIONS MERCK PATENT GMBH (DE) 2010-08-11 EP disclosed
US-7576242-B2 N-Ethylpyridinium bis(pentafluoroethyl)phosphinate; reacting tris(perfluoroalkyl)phosphine oxide is reacted with an alcohol and an organic base; ionic liquids MERCK PATENT GMBH (DE) 2009-08-18 US disclosed
US-20070287869-A1 Ionic Liquids Having Uronium Or Thiouronium Cations MERCK PATENT GMBH (DE) 2007-12-13 US disclosed
US-20070128515-A1 Process for the preparation of organic salts containing bis(perfluoroalkyl) phosphinate anions MERCK PATENT GMBH (DE) 2007-06-07 US disclosed
EP-1685095-A1 METHOD FOR THE PRODUCTION OF ORGANIC SALTS CONTAINING BIS(PERFLUOROALKYL)PHOSPHINATE ANIONS MERCK PATENT GmbH (DE) 2006-08-02 EP disclosed
EP-1628952-A1 IONIC LIQUID COMPRISING URONIUM CATIONS OR THIOURONIUM CATIONS MERCK PATENT GmbH (DE) 2006-03-01 EP disclosed
WO-2005049555-A1 METHOD FOR THE PRODUCTION OF ORGANIC SALTS CONTAINING BIS(PERFLUOROALKYL)PHOSPHINATE ANIONS MERCK PATENT GMBH (DE) 2005-06-02 WO disclosed
WO-2004106287-A1 IONIC LIQUID COMPRISING URONIUM CATIONS OR THIOURONIUM CATIONS MERCK PATENT GMBH (DE) 2004-12-09 WO disclosed