SCHEMBL419151

SCHEMBL419151

O=C=Nc1cc(C(F)(F)F)cc(C(F)(F)F)c1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CES2 O00748 1/20 0.41
ITGB3 P05106 1/20 0.41
ITGAV P06756 1/20 0.41
TDP1 Q9NUW8 2/20 0.38
MAPK1 P28482 1/20 0.38
CYP3A4 P08684 3/20 0.35
TSHR P16473 2/20 0.35
TRPA1 O75762 1/20 0.35
IDO1 P14902 2/20 0.33
HTR3E A5X5Y0 1/20 0.33
HTR3B O95264 1/20 0.33
HTR3A P46098 1/20 0.33
HTR3D Q70Z44 1/20 0.33
HTR3C Q8WXA8 1/20 0.33
MAPT P10636 1/20 0.33
RXRA P19793 1/20 0.33
RXRB P28702 1/20 0.33
RXRG P48443 1/20 0.33
RPS6KA3 P51812 1/20 0.33
JAK3 P52333 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
SCHEMBL60268 0.88 RXRA (0.34) CES2ITGB3ITGAVTDP1MAPK1
SCHEMBL2654231 0.86 NOTUM (0.40) CES2ITGB3ITGAVTDP1MAPK1
SCHEMBL16368740 0.86 CYP3A4 (0.38) CES2ITGB3ITGAVTDP1MAPK1
SCHEMBL22572895 0.82 CYP3A4 (0.35) CYP3A4TSHRTRPA1IDO1
SCHEMBL856528 0.82 RXRA (0.40) TDP1CYP3A4TRPA1MAPTRXRA
SCHEMBL1946009 0.80 ALDH1A1 (0.41) TDP1MAPK1CYP3A4TSHRMAPT
SCHEMBL58454 0.79 HTR3E (0.53) CES2TDP1MAPK1TSHRHTR3E
SCHEMBL29525471 0.79 HTR3E (0.53) CES2TDP1MAPK1TSHRHTR3E
SCHEMBL1019463 0.77 ITGB3 (0.41) CES2ITGB3ITGAVIDO1HTR3E
SCHEMBL20857727 0.77 ITGB3 (0.41) CES2ITGB3ITGAVIDO1HTR3E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4721152-A2 ORGANIC THIN FILM COATINGS FOR BATTERY MATERIALS Coreshell Technologies, Inc. (US) 2026-04-08 EP claimed
CN-115515998-B Synthesis of polyurethanes by chain growth copolymerization 伊夫·雅努 2025-06-24 CN claimed
CN-120137484-A Woodenware finishing paint based on epoxy resin and production method thereof 大一(云浮)新材料科技有限公司 2025-06-13 CN claimed
CN-119799308-B Waterproof locking agent for oilfield fracturing and production process thereof 克拉玛依市新聚工贸有限责任公司 2025-06-03 CN claimed
CN-117004037-B Functionalized column arene polyrotaxane and preparation method and application thereof 浙江大学杭州国际科创中心 2025-04-11 CN claimed
CN-119799308-A Waterproof locking agent for oilfield fracturing and production process thereof 克拉玛依市新聚工贸有限责任公司 2025-04-11 CN claimed
CN-119080658-A Single-molecule difunctional organic catalyst and preparation method and application thereof 浙江大学 2024-12-06 CN claimed
WO-2024249841-A2 ORGANIC THIN FILM COATINGS FOR BATTERY MATERIALS CORESHELL TECHNOLOGIES, INC. (US) 2024-12-05 WO claimed
US-20240360087-A1 THERMODYNAMICALLY STABLE FORM OF SCO-101 SCANDION ONCOLOGY A/S (DK) 2024-10-31 US claimed
US-20240332628-A1 Silicon-Based Energy Storage Devices With Electrolyte Containing Cyanate Based Compounds ENEVATE CORP (US) 2024-10-03 US claimed
WO-2021158366-A1 SILICON-BASED ENERGY STORAGE DEVICES WITH ELECTROLYTE CONTAINING CYANATE BASED COMPOUNDS ENEVATE CORPORATION (US) 2021-08-12 WO claimed
US-20210249689-A1 SILICON-BASED ENERGY STORAGE DEVICES WITH ELECTROLYTE CONTAINING CYANATE BASED COMPOUNDS ENEVATE CORPORATION 2021-08-12 US claimed
US-10734683-B2 Additive containing electrolytes for high energy rechargeable metal anode batteries Viking Power Systems Pte. Ltd. (SG) 2020-08-04 US claimed
EP-3497738-A1 ADDITIVE CONTAINING ELECTROLYTES FOR HIGH ENERGY RECHARGEABLE METAL ANODE BATTERIES Pellion Technologies Inc. (US) 2019-06-19 EP claimed
CN-108912599-A The filter film that a kind of nitrile rubber and phenolic resin compound 长春峰泰汽车胶业有限公司 2018-11-30 CN claimed
US-20180048017-A1 ADDITIVE CONTAINING ELECTROLYTES FOR HIGH ENERGY RECHARGEABLE METAL ANODE BATTERIES PELLION TECHNOLOGIES, INC. (US) 2018-02-15 US claimed
US-20180048025-A1 ADDITIVE CONTAINING ELECTROLYTES FOR HIGH ENERGY RECHARGEABLE METAL ANODE BATTERIES PELLION TECHNOLOGIES, INC. (US) 2018-02-15 US claimed
EP-1377589-B1 OXAZOLYL-PYRAZOLE DERIVATIVES AS KINASE INHIBITORS PHARMACIA ITALIA SPA (IT) 2005-09-07 EP claimed
US-6458503-B1 BLEND WITH DIAZO RESIN; LITHOGRAPHIC PRINTING PLATES; PHOTOPOLYMERIZATION AND CROSSLINKING KODAK POLYCHROME GRAPHICS LLC 2002-10-01 US claimed
WO-2002073315-A1 FLUORINATED AROMATIC ACETAL POLYMERS AND PHOTOSENSITIVE COMPOSITIONS CONTAINING SUCH POLYMERS KODAK POLYCHROME GRAPHICS COMPANY, LTD. (US) 2002-09-19 WO claimed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (3 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-20240332628-A1 Silicon-Based Energy Storage Devices With Electrolyte Containing Cyanate Based Compounds SIRT3, SLC6A12, HCN2 CES2 321/4885ITGB3 3257/4885ITGAV 3353/4885
US-20210249689-A1 SILICON-BASED ENERGY STORAGE DEVICES WITH ELECTROLYTE CONTAINING CYANATE BASED COMPOUNDS SIRT3, SLC6A12, HCN2 CES2 321/4885ITGB3 3257/4885ITGAV 3353/4885
US-20240360087-A1 THERMODYNAMICALLY STABLE FORM OF SCO-101 SCO2, SFXN1, IPO11 CES2 4654/4885ITGB3 4326/4885ITGAV 4361/4885

“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.