SCHEMBL7772033

SCHEMBL7772033

FC(F)C(F)(F)c1ccccc1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 3/20 0.52
ALDH1A1 P00352 2/20 0.52
PTPN1 P18031 2/20 0.41
CA1 P00915 1/20 0.39
CA2 P00918 1/20 0.39
CA5A P35218 1/20 0.39
CA9 Q16790 1/20 0.39
KCNN4 O15554 3/20 0.39
KIF11 P52732 1/20 0.39
NPSR1 Q6W5P4 2/20 0.36
MAPK1 P28482 3/20 0.35
HSD17B10 Q99714 2/20 0.35
KDM4E B2RXH2 1/20 0.35
GAA P10253 1/20 0.35
HPGD P15428 1/20 0.35
LMNA P02545 2/20 0.34
S1PR4 O95977 1/20 0.34
MAPT P10636 1/20 0.34
S1PR1 P21453 1/20 0.34
PGK1 P00558 1/20 0.33

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
Benzenethiol SCHEMBL28483471 0.87 TSHR (0.41) TSHRALDH1A1PTPN1CA1CA2
SCHEMBL16428391 0.79 ALDH1A1 (0.48) TSHRALDH1A1PTPN1CA1CA2
SCHEMBL4001430 0.79 ALDH1A1 (0.48) TSHRALDH1A1PTPN1CA1CA2
SCHEMBL10419000 0.78 TSHR (0.52) TSHRALDH1A1PTPN1CA1CA2
SCHEMBL21834945 0.77 TSHR (0.46) TSHRALDH1A1PTPN1CA1CA2
SCHEMBL15574617 0.76 TSHR (0.50) TSHRALDH1A1PTPN1CA1CA2
SCHEMBL12356881 0.76 ALDH1A1 (0.50) TSHRALDH1A1PTPN1CA1CA2
SCHEMBL28570663 0.76 MAPK1 (0.43) CA1CA2CA9KCNN4MAPK1
SCHEMBL24342382 0.74 ALDH1A1 (0.48) TSHRALDH1A1PTPN1KCNN4MAPK1
SCHEMBL10511820 0.74

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
CN-112830862-B Novel fluorine-containing flame retardant, synthetic method and application thereof in nylon 6 modification 三明学院 2023-04-18 CN claimed
CN-112830862-A Novel fluorine-containing flame retardant, synthetic method and application thereof in nylon 6 modification 三明学院 2021-05-25 CN claimed
EP-1119536-A1 NOVEL BROMINE-CONTAINING 1,2-BIS(PHENYL) TETRAFLUORO ETHANES AND METHOD OF IMPARTING FLAME RETARDANCY TO FLAMMABLE MATERIALS Great Lakes Chemical Corporation (US) 2001-08-01 EP claimed
WO-2000020363-A1 NOVEL BROMINE-CONTAINING 1,2-BIS(PHENYL) TETRAFLUORO ETHANES AND METHOD OF IMPARTING FLAME RETARDANCY TO FLAMMABLE MATERIALS GREAT LAKES CHEMICAL CORPORATION (US) 2000-04-13 WO claimed
CN-112830862-B Novel fluorine-containing flame retardant, synthetic method and application thereof in nylon 6 modification 三明学院 2023-04-18 CN disclosed
CN-112830862-B Novel fluorine-containing flame retardant, synthetic method and application thereof in nylon 6 modification 三明学院 2023-04-18 CN disclosed
EP-3178323-B1 NOXIOUS ARTHROPOD CONTROL AGENT CONTAINING AMIDE COMPOUND SUMITOMO CHEMICAL CO (JP) 2021-06-23 EP disclosed
CN-112830862-A Novel fluorine-containing flame retardant, synthetic method and application thereof in nylon 6 modification 三明学院 2021-05-25 CN disclosed
CN-112830862-A Novel fluorine-containing flame retardant, synthetic method and application thereof in nylon 6 modification 三明学院 2021-05-25 CN disclosed
US-10251396-B2 Amide compound and use of same for noxious arthropod control SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2019-04-09 US disclosed
US-9946175-B2 Electrophotographic photosensitive member, process cartridge, electrophotographic apparatus, and condensed polycyclic aromatic compound CANON KABUSHIKI KAISHA (JP) 2018-04-17 US disclosed
EP-2952096-B1 Amide compound, an arthropod pest control agent and a method for controlling arthropod pest SUMITOMO CHEMICAL CO (JP) 2018-04-04 EP disclosed
EP-2952096-A1 METHOD FOR CONTROLLING ARTHROPOD PEST Sumitomo Chemical Company, Limited (JP) 2015-12-09 EP disclosed
US-20150344466-A1 METHOD FOR CONTROLLING ARTHROPOD PEST SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2015-12-03 US disclosed
CN-104437296-A Sealing element for high borosilicate glass reaction kettle SHANGHAI YUANHUAI CHEMICAL TECHNOLOGY CO LTD 2015-03-25 CN disclosed
CN-104437297-A Hydrothermal synthesis reaction kettle inner container SHANGHAI YUANHUAI CHEMICAL TECHNOLOGY CO LTD 2015-03-25 CN disclosed
EP-1119536-A1 NOVEL BROMINE-CONTAINING 1,2-BIS(PHENYL) TETRAFLUORO ETHANES AND METHOD OF IMPARTING FLAME RETARDANCY TO FLAMMABLE MATERIALS Great Lakes Chemical Corporation (US) 2001-08-01 EP disclosed
WO-2000020363-A1 NOVEL BROMINE-CONTAINING 1,2-BIS(PHENYL) TETRAFLUORO ETHANES AND METHOD OF IMPARTING FLAME RETARDANCY TO FLAMMABLE MATERIALS GREAT LAKES CHEMICAL CORPORATION (US) 2000-04-13 WO disclosed
US-4071570-A ANTIARRHYTHMIC AGENTS MERCK & CO., INC. (US) 1978-01-31 US disclosed
US-3978127-A ANTIARRHYTHMIC MERCK & CO., INC. (US) 1976-08-31 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-20150344466-A1 METHOD FOR CONTROLLING ARTHROPOD PEST H1-0, H1-3, H1-2 TSHR 507/4885ALDH1A1 3053/4885PTPN1 1665/4885
US-10251396-B2 Amide compound and use of same for noxious arthropod control OPRM1, TRPA1, L3MBTL3 TSHR 2116/4885ALDH1A1 1868/4885PTPN1 2058/4885

“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.