SCHEMBL6932001

SCHEMBL6932001

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

nearest known ligand 0.36

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
SLC1A3 P43003 1/20 0.36
SLC1A2 P43004 1/20 0.36
SLC1A1 P43005 1/20 0.36
ACHE P22303 1/20 0.32
TP53 P04637 1/20 0.30

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
SCHEMBL9196637 1.00 SLC1A3 (0.36) SLC1A3SLC1A2SLC1A1ACHETP53
SCHEMBL6931998 1.00 SLC1A3 (0.36) SLC1A3SLC1A2SLC1A1ACHETP53
SCHEMBL14530119 0.80 SLC1A3 (0.33) SLC1A3SLC1A2SLC1A1
SCHEMBL21916633 0.79 ALDH1A1 (0.32) ACHE
SCHEMBL724845 0.78 SLC1A3 (0.39) SLC1A3SLC1A2SLC1A1TP53
SCHEMBL21881710 0.77 ACHE (0.31) ACHE
SCHEMBL9162000 0.77 ACHE (0.31) ACHE
SCHEMBL8600469 0.77 ACHE (0.45) ACHE
SCHEMBL6289513 0.77 ACHE (0.31) SLC1A3SLC1A2SLC1A1ACHE
SCHEMBL637417 0.76 SLC1A3 (0.37) SLC1A3SLC1A2SLC1A1TP53

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
JP-6256254-A None JP disclosed
US-20230159504-A1 7- OR 8-HYDROXY-ISOQUINOLINE AND 7- OR 8-HYDROXY-QUINOLINE DERIVATIVES AS ALPHA-1-ANTITRYPSIN MODULATORS FOR TREATING ALPHA-1-ANTITRYPSIN DEFICIENCY (AATD) VERTEX PHARMACEUTICALS INCORPORATED 2023-05-25 US disclosed
EP-2748158-A1 RADIOLABELED COMPOUNDS AND THEIR USE AS RADIOTRACERS FOR QUANTITATIVE IMAGING OF PHOSPHODIESTERASE (PDE10A) IN MAMMALS Takeda Pharmaceutical Company Limited (JP) 2014-07-02 EP disclosed
EP-2479161-B1 A novel process for producing 1,1,1,3,3,3-hexafluoro-2-methoxypropane DAIKIN IND LTD (JP) 2014-01-08 EP disclosed
WO-2013027845-A1 RADIOLABELED COMPOUNDS AND THEIR USE AS RADIOTRACERS FOR QUANTITATIVE IMAGING OF PHOSPHODIESTERASE (PDE10A) IN MAMMALS TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2013-02-28 WO disclosed
EP-2479161-A1 A novel process for producing 1,1,1,3,3,3-hexafluoro-2-methoxypropane Daikin Industries, Ltd. (JP) 2012-07-25 EP disclosed
US-7985877-B2 Carboxylic acid compound, use thereof, and process for producing the same DAIKIN INDUSTRIES, LTD. (JP) 2011-07-26 US disclosed
US-7985877-B2 Carboxylic acid compound, use thereof, and process for producing the same DAIKIN INDUSTRIES, LTD. (JP) 2011-07-26 US disclosed
US-20090156861-A1 NOVEL CARBOXYLIC ACID COMPOUND, USE THEREOF, AND PROCESS FOR PRODUCING THE SAME DAIKIN INDUSTRIES, LTD. (JP) 2009-06-18 US disclosed
US-20090156861-A1 NOVEL CARBOXYLIC ACID COMPOUND, USE THEREOF, AND PROCESS FOR PRODUCING THE SAME DAIKIN INDUSTRIES, LTD. (JP) 2009-06-18 US disclosed
EP-0592669-B1 OPTICALLY ACTIVE TRIFLUOROLACTIC ACID DERIVATIVE AND LIQUID CRYSTAL COMPOSITION CHISSO CORP (JP) 1998-01-28 EP disclosed
US-5693868-A REACTING 2,2'-BIS(TRIFLUOROMETHANESULFONYLOXY)-1,1-BINAPHTHYL WITH A PHOSPHINE OXIDE IN THE PRESENCE OF A TRANSITION METAL-PHOSPHINE COMPLEX TAKASAGO INTERNATIONAL CORPORATION (JP) 1997-12-02 US disclosed
US-5665270-A Optically active trifluorolactic acid derivative and liquid crystal composition CHISSO CORPORATION (JP) 1997-09-09 US disclosed
EP-0771812-A1 Method for producing an optically active diphosphine Takasago International Corporation (JP) 1997-05-07 EP disclosed
EP-0347066-B1 New enantiomers and their isolation LUNDBECK & CO AS H (DK) 1995-03-15 EP disclosed
JP-H06256254-A PRODUCTION OF 2-ALKYLOXY-3,3,3-TRIFLUOROPROPIONIC ACID JAPAN ENERGY CORP 1994-09-13 JP disclosed
US-RE34712-E Pharmaceutically useful (+)-1-(3-dimethylaminopropyl)-1-(4'-fluorophenyl)-1,3-dihydroiso benzofuran-5-carbonitrile and non-toxic acid addition salts thereof H. LUNDBECK A/S (DK) 1994-08-30 US disclosed
EP-0592669-A1 OPTICALLY ACTIVE TRIFLUOROLACTIC ACID DERIVATIVE AND LIQUID CRYSTAL COMPOSITION CHISSO CORPORATION (JP) 1994-04-20 EP disclosed
US-4943590-A ANTIDEPRESSANTS, STEREOSPECIFIC SYNTHESIS H. LUNDBECK A/S (DK) 1990-07-24 US disclosed
EP-0347066-A1 New enantiomers and their isolation H. LUNDBECK A/S (DK) 1989-12-20 EP 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-20230159504-A1 7- OR 8-HYDROXY-ISOQUINOLINE AND 7- OR 8-HYDROXY-QUINOLINE DERIVATIVES AS ALPHA-1-ANTITRYPSIN MODULATORS FOR TREATING ALPHA-1-ANTITRYPSIN DEFICIENCY (AATD) SERPINA2, SERPINB1, SERPINE1 SLC1A3 3451/4885SLC1A2 3521/4885SLC1A1 3319/4885
US-20090156861-A1 NOVEL CARBOXYLIC ACID COMPOUND, USE THEREOF, AND PROCESS FOR PRODUCING THE SAME HAO2, FTO, HCAR2 SLC1A3 509/4885SLC1A2 824/4885SLC1A1 435/4885

“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.