SCHEMBL28968670

SCHEMBL28968670

C=C(C)C(=O)OCCOC(=O)C(C)=COCCO

nearest known ligand 0.49

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
THRB P10828 1/20 0.49
TSHR P16473 4/20 0.43
ALDH1A1 P00352 2/20 0.35
POLB P06746 1/20 0.34
APEX1 P27695 1/20 0.34
HTT P42858 1/20 0.34
TDP1 Q9NUW8 1/20 0.34
CA1 P00915 1/20 0.30
CA2 P00918 1/20 0.30

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
SCHEMBL8629629 0.87 TSHR (0.39) THRBTSHR
SCHEMBL27388489 0.84 ALDH1A1 (0.34) THRBTSHRALDH1A1
SCHEMBL28701636 0.83 TSHR (0.56) THRBTSHRALDH1A1
SCHEMBL27621039 0.83 THRB (0.49) THRBTSHRALDH1A1POLBAPEX1
SCHEMBL28087290 0.82 THRB (0.52) THRBTSHRALDH1A1POLBAPEX1
SCHEMBL26980911 0.82 ACHE (0.37) THRBTSHRALDH1A1POLB
SCHEMBL7623060 0.81 THRB (0.63) THRBTSHRALDH1A1POLBAPEX1
SCHEMBL937816 0.80 GLO1 (0.42) THRBTSHRALDH1A1
SCHEMBL21836015 0.80 THRB (0.53) THRBTSHRALDH1A1POLBAPEX1
SCHEMBL28707259 0.80 THRB (0.39) THRBTSHRALDH1A1HTT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-115814158-B Wear-resistant lubricating coating similar to articular cartilage and preparation method thereof 中山大学 2024-02-23 CN disclosed
CN-115779159-B High-strength and high-toughness wear-resistant hydrophilic lubricating coating grafted on surface of medical instrument and preparation method thereof 中山大学 2024-01-16 CN disclosed
CN-115779159-B High-strength and high-toughness wear-resistant hydrophilic lubricating coating grafted on surface of medical instrument and preparation method thereof 中山大学 2024-01-16 CN disclosed
CN-115814158-A Articular cartilage-like wear-resistant lubricating coating and preparation method thereof 中山大学 2023-03-21 CN disclosed
CN-115779159-A High-strength-toughness wear-resistant hydrophilic lubricating coating grafted on surface of medical instrument and preparation method thereof 中山大学 2023-03-14 CN disclosed
CN-115779159-A High-strength-toughness wear-resistant hydrophilic lubricating coating grafted on surface of medical instrument and preparation method thereof 中山大学 2023-03-14 CN disclosed