SCHEMBL63469

SCHEMBL63469

FC(F)(F)c1ccccc1C(F)(F)F

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.52
TDP1 Q9NUW8 2/20 0.52
POLB P06746 1/20 0.52
L3MBTL1 Q9Y468 1/20 0.52
TSHR P16473 1/20 0.50
IDO1 P14902 2/20 0.48
LMNA P02545 2/20 0.46
GAA P10253 1/20 0.46
KIF11 P52732 2/20 0.44
HSD11B1 P28845 2/20 0.44
NFKB1 P19838 1/20 0.44
HTR2C P28335 2/20 0.43
MEN1 O00255 2/20 0.43
KMT2A Q03164 2/20 0.43
CA2 P00918 1/20 0.42
CYP1A2 P05177 1/20 0.41
CYP3A4 P08684 1/20 0.41
CYP2D6 P10635 1/20 0.41
MAPT P10636 1/20 0.41
CYP2C9 P11712 1/20 0.41

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
SCHEMBL29441997 1.00 ALDH1A1 (0.52) ALDH1A1TDP1POLBL3MBTL1TSHR
Hydrogen Sulfide SCHEMBL28274662 0.96 ALDH1A1 (0.50) ALDH1A1TDP1POLBL3MBTL1TSHR
Iodide SCHEMBL29093541 0.93 ALDH1A1 (0.48) ALDH1A1TDP1POLBL3MBTL1TSHR
Bromide SCHEMBL29093546 0.93 ALDH1A1 (0.48) ALDH1A1TDP1POLBL3MBTL1TSHR
SCHEMBL2380334 0.90 LMNA (0.46) ALDH1A1TDP1POLBL3MBTL1TSHR
SCHEMBL6565488 0.87 ALDH1A1 (0.44) ALDH1A1TDP1POLBL3MBTL1TSHR
SCHEMBL5486293 0.87 GAA (0.45) ALDH1A1TDP1POLBL3MBTL1TSHR
SCHEMBL6564279 0.87 ALDH1A1 (0.63) ALDH1A1TDP1POLBL3MBTL1TSHR
SCHEMBL15998876 0.85 ALDH1A1 (0.43) ALDH1A1TDP1POLBL3MBTL1TSHR
SCHEMBL803038 0.85 ALDH1A1 (0.50) ALDH1A1TDP1POLBL3MBTL1TSHR

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 1937 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-120025521-A Preparation method and application of perfluoropolyether modified acrylate compound 东莞泰岳先进材料有限公司 2025-05-23 CN claimed
US-12122935-B2 Curable organopolysiloxane composition for forming film and production method for organopolysiloxane cured product film DOW TORAY CO., LTD. (JP) 2024-10-22 US claimed
CN-117942787-A Long-chain alkyl phenanthroimidazole covalent organic framework film for oil-water separation and preparation method and application thereof 齐齐哈尔大学 2024-04-30 CN claimed
CN-117199535-A Electrolyte, electrochemical device and electronic device 远景睿泰动力技术(上海)有限公司 2023-12-08 CN claimed
CN-114231221-B Insulating adhesive film and preparation method and application thereof 深圳市纽菲斯新材料科技有限公司 2023-05-12 CN claimed
CN-116003770-A Perfluoro polyether phosphate compound and preparation method and application thereof 湖南柯盛新材料有限公司 2023-04-25 CN claimed
CN-115725574-A Small interfering RNA (siRNA) containing trifluoromethyl base analog 上海交通大学医学院附属仁济医院 2023-03-03 CN claimed
CN-115725573-A Antisense oligonucleotide containing trifluoromethyl base analogue 上海交通大学医学院附属仁济医院 2023-03-03 CN claimed
CN-115477572-A Preparation method of trifluoromethyl trifluoro-triphenylene discotic liquid crystal compound 四川师范大学 2022-12-16 CN claimed
CN-115197946-A Aptamer containing trifluoromethyl base analogue and application thereof 上海交通大学医学院附属仁济医院 2022-10-18 CN claimed
EP-0535597-B1 Method for preparing alpha, omega-dihydroxyperfluoroalkyl ethylmethylpolysiloxanes DOW CORNING TORAY SILICONE (JP) 1996-05-22 EP claimed
US-5362477-A 19F magnetic resonance imaging agents which include a nitroxide moiety MALLINCKRODT MEDICAL, INC. (US) 1994-11-08 US claimed
EP-0587440-A2 Catalyst component for the polymerisation of olefins and process for preparing olefin polymers using same NIPPON OIL COMPANY, LIMITED (JP) 1994-03-16 EP claimed
US-5233005-A METHOD FOR PREPARING ALPHA, OMEGA-DIHYDROXYPERFLUOROALKYLETHYLMETHYLPOLYSILOXANES DOW CORNING TORAY SILICONE CO., LTD. (JP) 1993-08-03 US claimed
EP-0535597-A1 Method for preparing alpha, omega-dihydroxyperfluoroalkyl ethylmethylpolysiloxanes Dow Corning Toray Silicone Company, Limited (JP) 1993-04-07 EP claimed
US-5177302-A Inclusion Complexes with Substituted Cyclodextrins DIRECTOR-GENERAL, AGENCY OF INDUSTRIAL SCIENCE AND TECHNOLOGY (JP) 1993-01-05 US claimed
CN-1054068-A Lithiation of 1, 3-bis (trifluoromethyl) benzene HOFFMANN LA ROCHE (CH) 1991-08-28 CN claimed
US-4849557-A Preparation of trifluoromethyltoluene from halomethylbenzotrifluoride CENTRAL GLASS COMPANY, LIMITED (JP) 1989-07-18 US claimed
EP-0251408-A1 Novel anti-inflammatory agents, pharmaceutical compositions and methods for reducing inflammation THE PROCTER & GAMBLE COMPANY (US) 1988-01-07 EP claimed
US-4059610-A Process for preparing isocyanic acid derivatives KAO SOAP CO., LTD. (JA) 1977-11-22 US claimed