SCHEMBL3095451

SCHEMBL3095451

C=C(C)C(=O)OP(=O)(CC)OCC

nearest known ligand 0.56

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
TSHR P16473 5/20 0.52
PPARD Q03181 2/20 0.41
THRB P10828 1/20 0.40
ALDH1A1 P00352 2/20 0.37
MAPT P10636 2/20 0.33
MAPK1 P28482 1/20 0.33
TP53 P04637 1/20 0.32
TDP1 Q9NUW8 1/20 0.32
CA12 O43570 1/20 0.32
CA1 P00915 1/20 0.32
CA2 P00918 1/20 0.32
CA9 Q16790 1/20 0.32

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
SCHEMBL2812644 0.88 ALDH1A1 (0.42) TSHRTHRBALDH1A1TDP1
SCHEMBL31454007 0.83 TSHR (0.56) TSHRPPARDTHRBALDH1A1MAPT
SCHEMBL29273922 0.83 TSHR (0.50) TSHRPPARDTP53TDP1CA12
SCHEMBL27900263 0.81 PPARD (0.39) TSHRPPARDTHRBALDH1A1MAPT
SCHEMBL17350563 0.80 TSHR (0.52) TSHRPPARDTHRBALDH1A1MAPT
SCHEMBL3630684 0.80 TSHR (0.48) TSHRPPARDTHRBALDH1A1TP53
SCHEMBL4167475 0.80 TSHR (0.48) TSHRPPARDTHRBALDH1A1TP53
Methacrylic Acid SCHEMBL28439280 0.80 TSHR (0.62) TSHRPPARDTHRBALDH1A1MAPT
SCHEMBL28815269 0.80 PPARD (0.38) TSHRPPARDTHRBALDH1A1
SCHEMBL361873 0.80 CHRM5 (0.38) TSHRTHRBMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-111381470-B Toner and method for producing the same 佳能株式会社 2024-05-24 CN disclosed
CN-110554583-B Process cartridge and electrophotographic apparatus 佳能株式会社 2024-04-02 CN disclosed
CN-112445090-B Toner and method for producing the same 佳能株式会社 2024-03-08 CN disclosed
CN-117406569-A Toner and method for producing the same 佳能株式会社 2024-01-16 CN disclosed
CN-117270348-A Toner and method for producing the same 佳能株式会社 2023-12-22 CN disclosed
CN-117148692-A Core-shell particles and toners 佳能株式会社 2023-12-01 CN disclosed
US-20220220031-A1 GRANULATE MATERIAL AND ASSOCIATED COATING THAT IS LOW IN ODOR AND EMISSIONS, PARTICULARLY A CONSTRUCTION ELEMENT COATING, FOR EXAMPLE A FLOOR COATING, BASED ON A RADICAL POLYMERIZATION SIDEC NV (BE) 2022-07-14 US disclosed
WO-2020239877-A1 GRANULATE MATERIAL AND ASSOCIATED COATING THAT IS LOW IN ODOR AND EMISSIONS, PARTICULARLY A CONSTRUCTION ELEMENT COATING, FOR EXAMPLE A FLOOR COATING, BASED ON A RADICAL POLYMERIZATION SIDEC NV (BE) 2020-12-03 WO disclosed
US-20100252069-A1 METHOD OF RECOVERING IMPREGNATING AGENT COMPOSITIONS EVONIK ROEHM GMBH (DE) 2010-10-07 US disclosed