SCHEMBL1950217

SCHEMBL1950217

O=C(C(=O)C(F)(F)C(F)(F)CF)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
SCHEMBL1950932 0.85
SCHEMBL7947968 0.81 THRB (0.33)
SCHEMBL7947942 0.77 FAAH (0.33)
SCHEMBL30495538 0.76 CES2 (0.32)
SCHEMBL4576284 0.75
SCHEMBL70056 0.72 CA2 (0.41)
SCHEMBL719462 0.72 ACLY (0.42)
SCHEMBL2138458 0.72
SCHEMBL5078106 0.71 THRB (0.33)
SCHEMBL810050 0.70

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6248928-B1 REACTING STRONTIUM WITH A STERICALLY HINDERED ALCOHOL TO PRODUCE STRONTIUM ALKOXIDE; REACTING THE STRONTIUM ALKOXIDE WITH A BETA-DIKETONE TO FORM A STRONTIUM BETA-DIKETONATE ALCOHOL ADDUCT AND REMOVING THE ALCOHOL INORGTECH LIMITED (GB) 2001-06-19 US claimed
US-6410805-B1 None US disclosed
EP-2151446-B1 Process for the preparation of bidentate schiff base ruthenium catalysts containing a salicylaldimine-type ligand RIMTEC CORP (JP) 2016-04-13 EP disclosed
EP-2151445-B1 Process for the preparation of bidentate Schiff base ruthenium catalysts containing a salicylaldimine-type ligand RIMTEC CORP (JP) 2015-02-18 EP disclosed
US-8338613-B2 Process for the preparation of bidentate schiff base ruthenium catalysts containing a salicylaldimine-type ligand RIMTEC CORPORATION (JP) 2012-12-25 US disclosed
US-20110137043-A1 Process for the preparation of bidentate schiff base ruthenium catalysts containing a salicylaldimine-type ligand TELENE S.A.S. (FR) 2011-06-09 US disclosed
US-20110065925-A1 Process for the preparation of bidentate schiff base ruthenium catalysts containing a salicylaldimine-type ligand TELENE S.A.S. (FR) 2011-03-17 US disclosed
EP-2151446-A1 Process for the preparation of bidentate schiff base ruthenium catalysts containing a salicylaldimine-type ligand Telene SAS (FR) 2010-02-10 EP disclosed
EP-2151445-A1 Process for the preparation of bidentate Schiff base ruthenium cataysts containing a saliclyldimine-type ligand Telene SAS (FR) 2010-02-10 EP disclosed
EP-1154975-B1 METHOD AND COMPOSITION FOR HYDROXYLATION OF AROMATIC SUBSTRATES GEN ELECTRIC (US) 2004-05-19 EP disclosed
US-6323378-B2 BY REACTING IN THE PRESENCE OF OXYGEN, A CATALYST, A PROTON SOURCE SUCH AS TRIFLUOROACETIC ACID AND NON-GASEOUS REDUCTANT(S) SUCH AS FERROCENE; EFFICIENCY; BENZENE TO PHENOL FOR EXAMPLE GENERAL ELECTRIC COMPANY 2001-11-27 US disclosed
EP-1154975-A2 METHOD AND COMPOSITION FOR HYDROXYLATION OF AROMATIC SUBSTRATES GENERAL ELECTRIC COMPANY (US) 2001-11-21 EP disclosed
EP-1154972-A1 METHOD AND COMPOSITION FOR HYDROXYLATION OF AROMATIC SUBSTRATES GENERAL ELECTRIC COMPANY (US) 2001-11-21 EP disclosed
US-20010039365-A1 Method and composition for hydroxylation of aromatic substrates SABIC INNOVATIVE PLASTICS IP B.V. (NL) 2001-11-08 US disclosed
US-6265622-B1 REACTING AROMATIC SUBSTRATE HAVING ACTIVE AROMATIC HYDROGEN IN PRESENCE OF OXYGEN, HYDROGEN AND CATALYST, WHEREIN CATALYST IS FORMED IN SOLUTION FROM AVANADIUM, NIOBIUM, OR TANTALUM PRECURSOR OR MIXTURE, ANIONIC AND NEUTRAL LIGANDS GENERAL ELECTRIC COMPANY 2001-07-24 US disclosed
US-6248928-B1 REACTING STRONTIUM WITH A STERICALLY HINDERED ALCOHOL TO PRODUCE STRONTIUM ALKOXIDE; REACTING THE STRONTIUM ALKOXIDE WITH A BETA-DIKETONE TO FORM A STRONTIUM BETA-DIKETONATE ALCOHOL ADDUCT AND REMOVING THE ALCOHOL INORGTECH LIMITED (GB) 2001-06-19 US disclosed
US-20010003139-A1 Method and composition for hydroxylation of aromatic substrates SABIC INNOVATIVE PLASTICS IP B.V. (NL) 2001-06-07 US disclosed
US-6232510-B1 REACTING AROMATIC SUBSTRATE IN PRESENCE OF OXYGEN, PROTON SOURCE, NON-GASEOUS REDUCTANT AND CATALYST FORMED IN SOLUTION FROM VANADIUM, NIOBIUM AND/OR TANTALUM PRECURSOR, ANIONIC LIGAND PRECURSOR, NEUTRAL ELECTRON-DONATING LIGAND PRECURSOR GENERAL ELECTRIC COMPANY 2001-05-15 US disclosed
WO-2000050371-A2 METHOD AND COMPOSITION FOR HYDROXYLATION OF AROMATIC SUBSTRATES GENERAL ELECTRIC COMPANY (US) 2000-08-31 WO disclosed
WO-2000050364-A1 METHOD AND COMPOSITION FOR HYDROXYLATION OF AROMATIC SUBSTRATES GENERAL ELECTRIC COMPANY (US) 2000-08-31 WO disclosed