SCHEMBL10165246

SCHEMBL10165246

CC(O)(c1cccc(C(O)(C(F)(F)F)C(F)(F)F)c1)C(F)(F)F

nearest known ligand 0.44

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
NR1H3 Q13133 9/20 0.44
MEN1 O00255 1/20 0.43
ALOX15 P16050 1/20 0.43
TSHR P16473 1/20 0.43
MAPK1 P28482 1/20 0.43
KMT2A Q03164 1/20 0.43
HSD17B10 Q99714 1/20 0.43
NR1H2 P55055 6/20 0.43
RORC P51449 3/20 0.42
RORA P35398 1/20 0.42
HSD11B1 P28845 3/20 0.42
AR P10275 2/20 0.40
PGR P06401 1/20 0.39
PGK1 P00558 1/20 0.38
PGK2 P07205 1/20 0.38

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
SCHEMBL832913 0.87 NR1H3 (0.47) NR1H3MEN1ALOX15TSHRMAPK1
SCHEMBL17914398 0.86 ACHE (0.50) ALOX15HSD17B10HSD11B1PGK1PGK2
SCHEMBL10165224 0.86 HSD11B1 (0.43) NR1H3HSD11B1PGK1PGK2
SCHEMBL19734501 0.86 ACHE (0.50) NR1H3MEN1ALOX15TSHRMAPK1
SCHEMBL24436844 0.84 NR1H3 (0.44) NR1H3MEN1ALOX15TSHRMAPK1
SCHEMBL26548517 0.84 NR1H3 (0.44) NR1H3MEN1ALOX15TSHRMAPK1
SCHEMBL13965655 0.83 NR1H3 (0.48) NR1H3NR1H2HSD11B1
SCHEMBL13965654 0.82 PTPN5 (0.46) HSD11B1
SCHEMBL29509593 0.81 TSHR (0.50) NR1H3MEN1ALOX15TSHRMAPK1
SCHEMBL24901407 0.81 TSHR (0.50) NR1H3MEN1ALOX15TSHRMAPK1

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 18 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10457759-B2 Co-delivery of cholesterol lowering drugs and nutraceuticals INTERNATIONAL BUSINESS MACHINES CORPORATION (US) 2019-10-29 US disclosed
US-20190023824-A1 CO-DELIVERY OF CHOLESTEROL LOWERING DRUGS AND NUTRACEUTICALS INTERNATIONAL BUSINESS MACHINES CORPORATION 2019-01-24 US disclosed
US-9650451-B2 Fluorine-containing compounds and their polymers useful for anti-reflection film materials and resist compositions CENTRAL GLASS COMPANY, LIMITED (JP) 2017-05-16 US disclosed
US-20170114183-A1 METHODS OF FORMING BLOCK POLYMERS FOR DIRECTED SELF-ASSEMBLY INTERNATIONAL BUSINESS MACHINES CORPORATION 2017-04-27 US disclosed
US-8981163-B2 Fluorine-containing aromatic compound and method for producing same Centrall Glass Company, Limited (JP) 2015-03-17 US disclosed
US-20140194655-A1 Fluorine-Containing Aromatic Compound and Method for Producing Same CENTRAL GLASS COMPANY, LIMITED (JP) 2014-07-10 US disclosed
US-20140171584-A1 Fluorine-Containing Compounds and Their Polymers Useful for Anti-Reflection Film Materials and Resist Compositions CENTRAL GLASS COMPANY, LIMITED (JP) 2014-06-19 US disclosed
US-8410290-B2 Cyclic carbonyl compounds with pendant carbonate groups, preparations thereof, and polymers therefrom INTERNATIONAL BUSINESS MACHINES CORPORATION (US) 2013-04-02 US disclosed
US-8389746-B2 Cyclic carbonyl compounds with pendant carbonate groups, preparations thereof, and polymers therefrom INTERNATIONAL BUSINESS MACHINES CORPORATION (US) 2013-03-05 US disclosed
US-8361495-B2 Antimicrobial polymers and methods of manufacture thereof INTERNATIONAL BUSINESS MACHINES CORPORATION (US) 2013-01-29 US disclosed
US-20120252983-A1 CYCLIC CARBONYL COMPOUNDS WITH PENDANT CARBONATE GROUPS, PREPARATIONS THEREOF, AND POLYMERS THEREFROM CENTRAL GLASS CO., LTD. (JP) 2012-10-04 US disclosed
US-20120245304-A1 CYCLIC CARBONYL COMPOUNDS WITH PENDANT CARBONATE GROUPS, PREPARATIONS THEREOF, AND POLYMERS THEREFROM CENTRAL GLASS CO., LTD. (JP) 2012-09-27 US disclosed
US-8207351-B2 Cyclic carbonyl compounds with pendant carbonate groups, preparations thereof, and polymers therefrom INTERNATIONAL BUSINESS MACHINES CORPORATION (US) 2012-06-26 US disclosed
WO-2011135046-A1 CYCLIC CARBONYL COMPOUNDS WITH PENDANT PENTAFLUOROPHENYL CARBONATE GROUPS, PREPARATIONS THEREOF, AND POLYMERS THEREFROM INTERNATIONAL BUSINESS MACHINES CORPORATION (US) 2011-11-03 WO disclosed
US-20110269917-A1 CYCLIC CARBONYL COMPOUNDS WITH PENDANT CARBONATE GROUPS, PREPARATIONS THEREOF, AND POLYMERS THEREFROM CENTRAL GLASS CO., LTD. (JP) 2011-11-03 US disclosed
WO-2011136872-A1 POLYMERS BEARING PENDANT PENTAFLUOROPHENYL ESTER GROUPS, AND METHODS OF SYNTHESIS AND FUNCTIONALIZATION THEREOF INTERNATIONAL BUSINESS MACHINES CORP. (US) 2011-11-03 WO disclosed
US-20110196121-A1 Fluorine-Containing Compounds and their Polymers Useful for Anti-Reflection Film Materials and Resist Compositions CENTRAL GLASS COMPANY, LIMITED (JP) 2011-08-11 US disclosed
US-20110150977-A1 ANTIMICROBIAL POLYMERS AND METHODS OF MANUFACTURE THEREOF AGENCY FOR SCIENCE, TECHNOLOGY AND RESEARCH (SG) 2011-06-23 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 (7 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-20120252983-A1 CYCLIC CARBONYL COMPOUNDS WITH PENDANT CARBONATE GROUPS, PREPARATIONS THEREOF, AND POLYMERS THEREFROM NOTUM, PFAS, PCNA NR1H3 4668/4885MEN1 3439/4885ALOX15 816/4885
US-20110196121-A1 Fluorine-Containing Compounds and their Polymers Useful for Anti-Reflection Film Materials and Resist Compositions DNMT3B, DNMT3L, AFF1 NR1H3 997/4885MEN1 885/4885ALOX15 2960/4885
US-20140194655-A1 Fluorine-Containing Aromatic Compound and Method for Producing Same AFF1, AFF2, AFF4 NR1H3 621/4885MEN1 170/4885ALOX15 3262/4885
US-10457759-B2 Co-delivery of cholesterol lowering drugs and nutraceuticals STARD3, HMGCR, CETP NR1H3 41/4885MEN1 4236/4885ALOX15 965/4885
US-20110150977-A1 ANTIMICROBIAL POLYMERS AND METHODS OF MANUFACTURE THEREOF MLEC, NOD2, PAM NR1H3 4633/4885MEN1 3094/4885ALOX15 1355/4885
US-20190023824-A1 CO-DELIVERY OF CHOLESTEROL LOWERING DRUGS AND NUTRACEUTICALS STARD3, HMGCR, CETP NR1H3 41/4885MEN1 4236/4885ALOX15 965/4885
US-20110269917-A1 CYCLIC CARBONYL COMPOUNDS WITH PENDANT CARBONATE GROUPS, PREPARATIONS THEREOF, AND POLYMERS THEREFROM NOTUM, PFAS, PCNA NR1H3 4668/4885MEN1 3439/4885ALOX15 816/4885

“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.