SCHEMBL2000756

SCHEMBL2000756

FC(F)(F)c1cccc(C(F)(F)F)c1C(F)(F)F

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HSD11B1 P28845 2/20 0.46
ALDH1A1 P00352 2/20 0.41
POLB P06746 1/20 0.41
TDP1 Q9NUW8 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
AXL P30530 1/20 0.40
KIF11 P52732 1/20 0.40
PARP1 P09874 1/20 0.39
P2RX7 Q99572 1/20 0.39
CES1 P23141 1/20 0.39
IDO1 P14902 2/20 0.38
CA2 P00918 1/20 0.38
KDM4E B2RXH2 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
HSD17B10 Q99714 1/20 0.38
LMNA P02545 1/20 0.37
GAA P10253 1/20 0.37
CNR2 P34972 1/20 0.37
PNMT P11086 1/20 0.36
CHRNB2 P17787 1/20 0.36

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
Lithium SCHEMBL5691154 0.97 HSD11B1 (0.44) HSD11B1ALDH1A1POLBTDP1L3MBTL1
SCHEMBL22140077 0.87 CA2 (0.46) HSD11B1ALDH1A1POLBTDP1L3MBTL1
SCHEMBL20412806 0.87 HSD11B1 (0.43) HSD11B1ALDH1A1POLBTDP1L3MBTL1
SCHEMBL6067687 0.86 HSD11B1 (0.55) HSD11B1ALDH1A1POLBTDP1L3MBTL1
SCHEMBL942973 0.84 HSD11B1 (0.41) HSD11B1ALDH1A1POLBTDP1L3MBTL1
SCHEMBL14932033 0.84 HSD11B1 (0.41) HSD11B1ALDH1A1POLBTDP1L3MBTL1
SCHEMBL7602903 0.84 HSD11B1 (0.41) HSD11B1ALDH1A1POLBTDP1L3MBTL1
Phenol SCHEMBL28835876 0.83 CA12 (0.48) HSD11B1ALDH1A1TDP1KIF11IDO1
SCHEMBL4891656 0.82 HSD17B1 (0.41) HSD11B1ALDH1A1POLBTDP1L3MBTL1
SCHEMBL6157191 0.82 HSD11B1 (0.40) HSD11B1ALDH1A1POLBTDP1L3MBTL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-107108416-B Preparation method of 1, 2-dicyclopropylethylphenol and optical isomer thereof 四川海思科制药有限公司 2019-12-20 CN claimed
US-6998450-B1 Method for preparing a homo-and co-polymers by polymerization of cyclic olefin compounds using fluorine-containing aromatic hydrocarbon compound as catalyst activator KOREA KUMHO PETROCHEMICAL CO., LTD. (KR) 2006-02-14 US claimed
US-6713214-B2 ORGANIC MATERIAL INCLUDING CARBON HAVING A CONJUGATE ELECTRON CLOUD AND COUPLED WITH AN ELECTRON ATTRACTIVE GROUP OR A MATERIAL OBTAINED BY BAKING A FLUOROCARBON POLYMER OR GRAPHITE FLUORIDE SANYO ELECTRIC CO., LTD. (JP) 2004-03-30 US claimed
US-20020090550-A1 Organic material including carbon having a conjugate electron cloud and coupled with an electron attractive group or a material obtained by baking a fluorocarbon polymer or graphite fluoride SANYO ELECTRIC CO., LTD. (JP) 2002-07-11 US claimed
US-5362477-A 19F magnetic resonance imaging agents which include a nitroxide moiety MALLINCKRODT MEDICAL, INC. (US) 1994-11-08 US claimed
WO-2024143106-A1 STABILIZED ALKYL-BROMIDE-COMPOUND-CONTAINING LIQUID COMPOSITION AND USE FOR SAME 東ソー株式会社 2024-07-04 WO disclosed
WO-2024126528-A1 ORGANIC ELECTROLUMINESCENT DEVICE COMPRISING A COMPOUND OF FORMULA (I) AND A COMPOUND OF FORMULA (II), AND DISPLAY DEVICE COMPRISING THE ORGANIC ELECTROLUMINESCENT DEVICE NOVALED GMBH (DE) 2024-06-20 WO disclosed
WO-2024126619-A1 ORGANIC ELECTROLUMINESCENT DEVICE COMPRISING A COMPOUND OF FORMULA (I) AND A COMPOUND OF FORMULA (II), AND DISPLAY DEVICE COMPRISING THE ORGANIC ELECTROLUMINESCENT DEVICE NOVALED GMBH (DE) 2024-06-20 WO disclosed
US-11984317-B2 EUV patterning methods, structures, and materials INTEL CORPORATION (US) 2024-05-14 US disclosed
WO-2024046607-A1 ORGANIC ELECTROLUMINESCENT DEVICE COMPRISING A COMPOUND OF FORMULA (I) AND A COMPOUND OF FORMULA (II), AND DISPLAY DEVICE COMPRISING THE ORGANIC ELECTROLUMINESCENT DEVICE NOVALED GMBH (DE) 2024-03-07 WO disclosed
US-20240074304-A1 ORGANIC ELECTROLUMINESCENT DEVICE EMITTING BLUE LIGHT SAMSUNG DISPLAY CO., LTD. (KR) 2024-02-29 US disclosed
US-20240032317-A1 ORGANIC ELECTROLUMINESCENT DEVICE SAMSUNG DISPLAY CO., LTD. (KR) 2024-01-25 US disclosed
US-5397562-A Administering fluorocarbon emulsions, determination of oxygen tension, diagnosis of tumors based on degree of hypoxia BOARD OF REGENTS, THE UNIVERSITY OF TEXAS SYSTEM (US) 1995-03-14 US disclosed
US-5385724-A Trifluoromethyl analogs of X-ray contrast media for magnetic resonance imaging MALLINCKRODT MEDICAL, INC. (US) 1995-01-31 US disclosed
US-5385724-A Trifluoromethyl analogs of X-ray contrast media for magnetic resonance imaging MALLINCKRODT MEDICAL, INC. (US) 1995-01-31 US disclosed
US-5362477-A 19F magnetic resonance imaging agents which include a nitroxide moiety MALLINCKRODT MEDICAL, INC. (US) 1994-11-08 US disclosed
US-5318770-A Trifluoromethyl analogs of X-ray contrast media for magnetic resonance imaging MALLINCKRODT MEDICAL, INC. (US) 1994-06-07 US disclosed
US-5318770-A Trifluoromethyl analogs of X-ray contrast media for magnetic resonance imaging MALLINCKRODT MEDICAL, INC. (US) 1994-06-07 US disclosed
WO-1993007907-A1 TRIFLUOROMETHYL ANALOGS FOR F-19 NMR IMAGING MALLINCKRODT MEDICAL, INC. (US) 1993-04-29 WO disclosed
WO-1993007907-A1 TRIFLUOROMETHYL ANALOGS FOR F-19 NMR IMAGING MALLINCKRODT MEDICAL, INC. (US) 1993-04-29 WO disclosed