SCHEMBL177480

SCHEMBL177480

Fc1cc(OBOc2cc(F)c(F)c(F)c2)cc(F)c1F

nearest known ligand 0.35

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
CES2 O00748 1/20 0.35
CES1 P23141 1/20 0.35

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
SCHEMBL16654142 0.84
SCHEMBL4195444 0.80
SCHEMBL4641984 0.80 TUBB1 (0.37)
SCHEMBL14827136 0.79 CES2 (0.37) CES2CES1
SCHEMBL1277219 0.79 ESR1 (0.36)
SCHEMBL6677725 0.77 CES2 (0.31) CES2CES1
SCHEMBL177573 0.74 CA12 (0.36) CES2CES1
SCHEMBL177743 0.74 SOS1 (0.41) CES2CES1
SCHEMBL1786644 0.74
SCHEMBL27486692 0.73 CES2 (0.39) CES2CES1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9909030-B2 Method for preparing carbon nanotubes graphene modified aqueous polyurethane coatings and adhesives YANTAI UNIVERSITY (CN) 2018-03-06 US claimed
US-20170114248-A1 Method For Preparing Carbon Nanotubes Graphene Modified Aqueous Polyurethane Coatings and Adhesives YANTAI UNIVERSITY 2017-04-27 US claimed
EP-1277755-A1 OPTICALLY ACTIVE QUATERNARY AMMONIUM SALT WITH AXIAL ASYMMETRY, PROCESS FOR PRODUCING THE SAME, AND APPLICATION TO ASYMMETRIC SYNTHESIS OF $g(a)-AMINO ACID DERIVATIVE Nagase & Co., Ltd. (JP) 2003-01-22 EP claimed
US-20260102762-A1 TRI-(ADAMANTYL)PHOSPHINES AND APPLICATIONS THEREOF THE TRUSTEES OF PRINCETON UNIVERSITY (US) 2026-04-16 US disclosed
US-12539508-B2 Tri-(adamantyl) phosphines and applications thereof THE TRUSTEES OF PRINCETON UNIVERSITY (US) 2026-02-03 US disclosed
US-20250333383-A1 N-OXIDE COMPOUNDS AND USE THEREOF SK BIOPHARMACEUTICALS CO., LTD. (KR) 2025-10-30 US disclosed
WO-2025074339-A1 A PROCESS FOR PREPARATION OF CARBOXAMIDE COMPOUNDS AND INTERMEDIATES THEREOF UPL LIMITED (IN) 2025-04-10 WO disclosed
EP-4514777-A1 N-OXIDE COMPOUNDS AND USE THEREOF SK Biopharmaceuticals Co., Ltd. (KR) 2025-03-05 EP disclosed
US-20240001353-A1 TRI-(ADAMANTYL)PHOSPHINES AND APPLICATIONS THEREOF UNIV PRINCETON (US) 2024-01-04 US disclosed
EP-4286051-A2 A METHOD OF CROSS-COUPLING USING A TRANSITION METAL COMPLEX COMPRISING A PAD3 LIGAND The Trustees of Princeton University (US) 2023-12-06 EP disclosed
WO-2023211195-A1 N-OXIDE COMPOUNDS AND USE THEREOF SK BIOPHARMACEUTICALS CO., LTD. (KR) 2023-11-02 WO disclosed
US-20060205797-A1 Compounds for the treatment of inflammatory disorders SCHERING CORPORATION 2006-09-14 US disclosed
WO-2006079406-A1 MESOGENIC COMPOUNDS, LIQUID CRYSTAL MEDIUM AND LIQUID CRYSTAL DISPLAY MERCK PATENT GMBH (DE) 2006-08-03 WO disclosed
WO-2006019768-A1 HYDANTOIN DERIVATIVES FOR THE TREATMENT OF INFLAMMATORY DISORDERS SCHERING CORPORATION (US) 2006-02-23 WO disclosed
WO-2005073204-A1 SELECTIVE ESTROGEN RECEPTOR MODULATORS FOR THE TREATMENT OF VASOMOTOR SYMPTOMS ELI LILLY AND COMPANY (US) 2005-08-11 WO disclosed
EP-1277755-A1 OPTICALLY ACTIVE QUATERNARY AMMONIUM SALT WITH AXIAL ASYMMETRY, PROCESS FOR PRODUCING THE SAME, AND APPLICATION TO ASYMMETRIC SYNTHESIS OF $g(a)-AMINO ACID DERIVATIVE Nagase & Co., Ltd. (JP) 2003-01-22 EP disclosed
US-6441231-B1 SPIRO QUARTERNARY AMMONIUM SALT COMPOUNDS, USED AS PHASE TRANSFER CATALYST FOR STEREOSELECTIVE ALKYLATION NAGASE & CO., LTD. (JP) 2002-08-27 US disclosed
US-20020103374-A1 OPTICALLY ACTIVE QUARTERNARY AMMONIUM SALT WITH AXIAL CHIRALITY, METHOD FOR PRODUCING THEREOF, AND APPLICATION THEREOF FOR ASYMMETRIC SYNTHESIS OF ALPHA-AMINO ACID NAGASE & CO., LTD (JP) 2002-08-01 US disclosed
US-20020065414-A1 Optically active quarternary ammonium salt with axial chirality, method for producing thereof, and aplication thereof for asymmetric synthesis of alpha-amino acid NAGASE & CO., LTD. (JP) 2002-05-30 US disclosed
US-6340753-B1 CATIONIC QUATERNARY AMMONIUM COMPOUNDS DEHYDROHALOGENATION OF COMPOUNDS TO FORM AMINES NAGASE & CO., LTD. (JP) 2002-01-22 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-20250333383-A1 N-OXIDE COMPOUNDS AND USE THEREOF SCNN1B, SCN1B, SCN2B CES2 1584/4885CES1 3595/4885
US-20020065414-A1 Optically active quarternary ammonium salt with axial chirality, method for producing thereof, and aplication thereof for asymmetric synthesis of alpha-amino acid AADAT, AASDHPPT, BCAT1 CES2 3976/4885CES1 1963/4885
US-20060205797-A1 Compounds for the treatment of inflammatory disorders TNF, MMP12, MMP8 CES2 531/4885CES1 180/4885
US-12539508-B2 Tri-(adamantyl) phosphines and applications thereof OTC, AOC3, ICOSLG CES2 426/4885CES1 941/4885
US-20020103374-A1 OPTICALLY ACTIVE QUARTERNARY AMMONIUM SALT WITH AXIAL CHIRALITY, METHOD FOR PRODUCING THEREOF, AND APPLICATION THEREOF FOR ASYMMETRIC SYNTHESIS OF ALPHA-AMINO ACID AADAT, BCAT1, BCAT2 CES2 3731/4885CES1 1913/4885
US-20260102762-A1 TRI-(ADAMANTYL)PHOSPHINES AND APPLICATIONS THEREOF PTMS, TEC, CD2 CES2 1111/4885CES1 2044/4885
US-20240001353-A1 TRI-(ADAMANTYL)PHOSPHINES AND APPLICATIONS THEREOF PADI3, ADA, ENTPD3 CES2 563/4885CES1 1031/4885

“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.