SCHEMBL2524434

SCHEMBL2524434

O=C(O)COC(F)(C(F)F)C(F)(F)F

nearest known ligand 0.32

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
CTH P32929 1/20 0.32
CBS P35520 1/20 0.32
THPO P40225 1/20 0.32
THRB P10828 1/20 0.31

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

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
SCHEMBL6935812 0.77 TSHR (0.35) TSHRSMN1; SMN2CTHCBSTHPO
SCHEMBL6938567 0.74 TSHR (0.32) TSHRSMN1; SMN2CTHCBSTHPO
SCHEMBL31681398 0.72 TSHR (0.38) TSHRSMN1; SMN2CTHCBSTHPO
SCHEMBL11669967 0.72 TSHR (0.38) TSHRSMN1; SMN2CTHCBSTHPO
SCHEMBL15088592 0.71 TSHR (0.33) TSHRSMN1; SMN2CTHCBSTHPO
SCHEMBL6822598 0.71
SCHEMBL1118445 0.71
SCHEMBL29038650 0.70
SCHEMBL12269559 0.70 TSHR (0.41) TSHRSMN1; SMN2CTHCBSTHPO
SCHEMBL15547167 0.69 TSHR (0.30) TSHRSMN1; SMN2

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
CN-114502527-B Synthesis method of sevoflurane 鲁南贝特制药有限公司 2024-06-14 CN disclosed
CN-114502527-A Synthetic method of sevoflurane 鲁南贝特制药有限公司 2022-05-13 CN disclosed
WO-2021072774-A1 METHOD FOR SYNTHESIZING SEVOFLURANE 鲁南贝特制药有限公司 2021-04-22 WO disclosed
EP-2069278-B1 PROCESS FOR THE PREPARATION OF CHLOROMETHYL 2,2,2-TRIFLUORO-1-(TRIFLUOROMETHYL) ETHYL ETHER CRISTÁLIA PRODUTOS QUÍMICOS FARMACÊUTICOS LTDA (BR) 2016-01-06 EP disclosed
US-8044247-B2 Process for the preparation of fluoromethyl 2,2,2-trifluoro-1-(trifluoromethyl) ethyl ether Cristália Produtos Químicos Farmacêuticos Ltda. (BR) 2011-10-25 US disclosed
US-8039678-B2 Process for the preparation of chloromethyl 2,2,2-trifluoro-1-(trifluoromethyl) ethyl ether CRISTALIA PRODUTOS QUIMICOS FARMACEUTICOS LTDA. (BR) 2011-10-18 US disclosed
US-20100004490-A1 PROCESS FOR THE PREPARATION OF CHLOROMETHYL 2,2,2-TRIFLUORO-1-(TRIFLUOROMETHYL) ETHYL ETHER Cr1stalia Productos Quimicos Farmaceuticos LTDA (BR) 2010-01-07 US disclosed
US-20090247791-A1 PROCESS FOR THE PREPARATION OF FLUOROMETHYL 2,2,2-TRIFLUORO-1-(TRIFLUOROMETHYL) ETHYL ETHER CRISTÁLIA PRODUTOS QUÍMICOS FARMACÊUTICOS LTDA (BR) 2009-10-01 US disclosed
EP-2069278-A2 PROCESS FOR THE PREPARATION OF CHLOROMETHYL 2,2,2-TRIFLUORO-1-(TRIFLUOROMETHYL) ETHYL ETHER Cristália Produtos Químicos Farmacêuticos Ltda. (BR) 2009-06-17 EP disclosed
WO-2008037039-A2 PROCESS FOR THE PREPARATION OF CHLOROMETHYL 2,2,2-TRIFLUORO-1-(TRIFLUOROMETHYL) ETHYL ETHER Cristália Produtos Químicos Farmacêuticos Ltda. (BR) 2008-04-03 WO disclosed
EP-1286939-B1 METHOD FOR FLUOROMETHYLATION OF ALCOHOLS VIA HALOGENATIVE DECARBOXYLATION ABBOTT LAB (US) 2006-02-15 EP disclosed
CN-1446188-A Method for fluoromethylation of alcohols via halogenative decarboxylation ABBOTT LAB (US) 2003-10-01 CN disclosed
EP-1286939-A1 METHOD FOR FLUOROMETHYLATION OF ALCOHOLS VIA HALOGENATIVE DECARBOXYLATION Abbott Laboratories (US) 2003-03-05 EP disclosed
WO-2001094286-A1 METHOD FOR FLUOROMETHYLATION OF ALCOHOLS VIA HALOGENATIVE DECARBOXYLATION ABBOTT LABORATORIES (US) 2001-12-13 WO disclosed
US-6271422-B1 AN ALCOHOL IS REACTED WITH AN ALPHA-HALOESTER TO FORM AN ALPHA-ALKOXY ACID WHICH IS THEN DECARBOXYLATIVELY HALOGENATED TO FORM A CHLOROMETHYL ETHER. THE CHLOROMETHYL ETHER IS THEN CONVERTED TO THE DESIRED FLUORIDE ABBOTT LABORATORIES 2001-08-07 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (2 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20100004490-A1 PROCESS FOR THE PREPARATION OF CHLOROMETHYL 2,2,2-TRIFLUORO-1-(TRIFLUOROMETHYL) ETHYL ETHER PFDN2, PFAS, CA3 TSHR 1594/4885SMN1; SMN2 1679/4885CTH 37/4885
US-20090247791-A1 PROCESS FOR THE PREPARATION OF FLUOROMETHYL 2,2,2-TRIFLUORO-1-(TRIFLUOROMETHYL) ETHYL ETHER CA3, PFAS, PFDN2 TSHR 822/4885SMN1; SMN2 1622/4885CTH 206/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.