SCHEMBL6681534

SCHEMBL6681534

CCC(C(C)=O)C(=O)[O-].CCCC[O-].CCCC[O-].CCCC[O-].[Ti+4]

nearest known ligand 0.41

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
CA2 P00918 5/20 0.41
CA1 P00915 3/20 0.38
CES1 P23141 5/20 0.34
CYP3A4 P08684 2/20 0.34
TSHR P16473 2/20 0.34
NFKB1 P19838 2/20 0.34
NPSR1 Q6W5P4 2/20 0.34
CES2 O00748 4/20 0.33
MAPK1 P28482 1/20 0.31

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
SCHEMBL261344 1.00 CA2 (0.41) CA2CA1CES1CYP3A4TSHR
SCHEMBL1229453 0.96 CA2 (0.41) CA2CA1CES1CYP3A4TSHR
SCHEMBL1229548 0.96 CA2 (0.41) CA2CA1CES1CYP3A4TSHR
SCHEMBL1230029 0.96 CA2 (0.41) CA2CA1CES1CYP3A4TSHR
SCHEMBL829930 0.96 CA2 (0.41) CA2CA1CES1CYP3A4TSHR
SCHEMBL449993 0.96 CA2 (0.41) CA2CA1CES1CYP3A4TSHR
SCHEMBL1681963 0.96 CA2 (0.41) CA2CA1CES1CYP3A4TSHR
SCHEMBL5317232 0.90 CYP3A4 (0.38) CA2CA1CYP3A4TSHRNFKB1
SCHEMBL14813969 0.90 CYP3A4 (0.38) CA2CA1CYP3A4TSHRNFKB1
SCHEMBL418150 0.88 CA2 (0.36) CA2CA1TSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3467587-B1 LITHOGRAPHIC PRINTING ORIGINAL PLATE TORAY INDUSTRIES (JP) 2024-10-23 EP disclosed
EP-3267255-B1 LITHOGRAPHIC PRINTING ORIGINAL PLATE, METHOD FOR PRODUCING LITHOGRAPHIC PRINTING PLATE USING SAME, AND METHOD FOR PRODUCING PRINTED MATTER TORAY INDUSTRIES (JP) 2023-07-12 EP disclosed
EP-3783435-B1 LITHOGRAPHIC PRINTING ORIGINAL PLATE, METHOD FOR MANUFACTURING LITHOGRAPHIC PRINTING PLATE, AND METHOD FOR MANUFACTURING PRINTS USING SAME TORAY INDUSTRIES (JP) 2022-02-09 EP disclosed
EP-3222435-B1 METHOD FOR MANUFACTURING PRINTED MATTER TORAY INDUSTRIES (JP) 2021-11-24 EP disclosed
US-20210206189-A1 LITHOGRAPHIC PRINTING ORIGINAL PLATE, METHOD FOR MANUFACTURING LITHOGRAPHIC PRINTING PLATE, AND METHOD FOR MANUFACTURING PRINTS USING SAME TORAY INDUSTRIES, INC. (JP) 2021-07-08 US disclosed
EP-3783435-A1 LITHOGRAPHIC PRINTING ORIGINAL PLATE, METHOD FOR MANUFACTURING LITHOGRAPHIC PRINTING PLATE, AND METHOD FOR MANUFACTURING PRINTS USING SAME Toray Industries, Inc. (JP) 2021-02-24 EP disclosed
US-10889659-B2 Modified polymethylhydrosiloxane, modified high-cis conjugated diene polymer, and manufacturing method for the same, and rubber composition and tire using the same CHI MEI CORPORATION (TW) 2021-01-12 US disclosed
US-10850548-B2 Lithographic printing precursor TORAY INDUSTRIES, INC. (JP) 2020-12-01 US disclosed
US-20190241740-A1 MODIFIED POLYMETHYLHYDROSILOXANE, MODIFIED HIGH-CIS CONJUGATED DIENE POLYMER, AND MANUFACTURING METHOD FOR THE SAME, AND RUBBER COMPOSITION AND TIRE USING THE SAME CHI MEI CORPORATION (TW) 2019-08-08 US disclosed
US-20190143730-A1 LITHOGRAPHIC PRINTING PRECURSOR TORAY INDUSTRIES, INC. (JP) 2019-05-16 US disclosed
EP-2667251-A1 ORIGINAL PLATE FOR DIRECT-PATTERN WATERLESS PLANOGRAPHIC PRINTING PLATE Toray Industries, Inc. (JP) 2013-11-27 EP disclosed
EP-2664626-A1 MODIFIED CONJUGATED DIENE RUBBER, METHOD FOR PRODUCING SAME, AND RUBBER COMPOSITION JSR Corporation (JP) 2013-11-20 EP disclosed
US-20130298794-A1 DIRECTLY IMAGEABLE WATERLESS LITHOGRAPHIC PRINTING PLATE PRECURSOR TORAY INDUSTRIES, INC. (JP) 2013-11-14 US disclosed
US-20130296481-A1 MODIFIED CONJUGATED DIENE RUBBER, METHOD FOR PRODUCING SAME, AND RUBBER COMPOSITION JSR CORPORATION (JP) 2013-11-07 US disclosed
US-20130273473-A1 DIRECT DRAWING-TYPE WATERLESS LITHOGRAPHIC PRINTING ORIGINAL PLATE TORAY INDUSTRIES, INC. (JP) 2013-10-17 US disclosed
EP-2624053-A1 DIRECT DRAWING-TYPE WATERLESS LITHOGRAPHIC PRINTING ORIGINAL PLATE Toray Industries, Inc. (JP) 2013-08-07 EP disclosed
US-20130085228-A1 MODIFIED CONJUGATED DIENE RUBBER, METHOD FOR PRODUCING SAME, AND RUBBER COMPOSITION JSR CORPORATION (JP) 2013-04-04 US disclosed
EP-1029666-B1 Waterless planographic printing plate precursor and production method thereof FUJI PHOTO FILM CO LTD (JP) 2004-11-10 EP disclosed
US-6340526-B1 LASER WRITING IS POSSIBLE, SCRATCH RESISTANCE AND SOLVENT RESISTANCE, IMAGE REPRODUCIBILITY FUJI PHOTO FILM CO., LTD. (JP) 2002-01-22 US disclosed
EP-1029666-A1 Waterless planographic printing plate precursor and production method thereof FUJI PHOTO FILM CO., LTD. (JP) 2000-08-23 EP disclosed