SCHEMBL30701949

SCHEMBL30701949

COc1ccc(OC)c(OC)c1OC

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA9 Q16790 3/20 0.50
CA12 O43570 2/20 0.50
CA1 P00915 2/20 0.50
CA2 P00918 2/20 0.50
CA7 P43166 2/20 0.50
CA14 Q9ULX7 2/20 0.50
CA4 P22748 1/20 0.50
CYP1A1 P04798 1/20 0.48
CYP1B1 Q16678 1/20 0.48
AOC3 Q16853 1/20 0.48
MAPT P10636 3/20 0.48
TDP1 Q9NUW8 1/20 0.48
ACHE P22303 2/20 0.48
ALDH1A1 P00352 2/20 0.47
CYP19A1 P11511 1/20 0.47
POLB P06746 1/20 0.47
KMT2A Q03164 1/20 0.47
KDM4E B2RXH2 1/20 0.46
HPGD P15428 1/20 0.46
SMN1; SMN2 Q16637 1/20 0.46

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
SCHEMBL3674074 1.00 CA9 (0.50) CA9CA12CA1CA2CA7
SCHEMBL28322511 0.91 CYP1A1 (0.44) CA9CA12CA1CA2CA7
SCHEMBL642228 0.88 HDAC4 (0.58) MAPTACHEALDH1A1KDM4EHPGD
SCHEMBL4635687 0.86 AOC3 (0.41) CA9CA12CA1CA2CA7
SCHEMBL5027487 0.86 CYP1A1 (0.41) CA9CA12CA1CA2CA7
SCHEMBL1226775 0.86 ALDH1A1 (0.46) CYP1A1CYP1B1AOC3MAPTTDP1
SCHEMBL29767819 0.86 ALDH1A1 (0.46) CYP1A1CYP1B1AOC3MAPTTDP1
SCHEMBL1226886 0.84 CYP1A1 (0.40) CA9CA12CA1CA2CA7
SCHEMBL365673 0.84 AOC3 (0.40) CA9CA12CA1CA2CA7
SCHEMBL1337492 0.84 MAPT (0.44) CYP1A1CYP1B1AOC3MAPTTDP1

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-119534708-A Method for determining methoxybenzene compounds in tea based on multiple headspace solid-phase microextraction 湖南农业大学 2025-02-28 CN claimed
CN-119529381-A Extraction agent and method for purifying monomers of polymers containing ester functions 韩国化学研究院 2025-02-28 CN claimed
CN-119384454-A Depolymerization process of polymers containing ester functionalities using mixed organic solvents 韩国化学研究院 2025-01-28 CN claimed
CN-115734981-B Efficient depolymerization process for polymers containing ester functionalities and purification process therefor 韩国化学研究院 2024-12-06 CN claimed
CN-119534708-A Method for determining methoxybenzene compounds in tea based on multiple headspace solid-phase microextraction 湖南农业大学 2025-02-28 CN disclosed
CN-119529381-A Extraction agent and method for purifying monomers of polymers containing ester functions 韩国化学研究院 2025-02-28 CN disclosed
CN-119384454-A Depolymerization process of polymers containing ester functionalities using mixed organic solvents 韩国化学研究院 2025-01-28 CN disclosed
CN-115734981-B Efficient depolymerization process for polymers containing ester functionalities and purification process therefor 韩国化学研究院 2024-12-06 CN disclosed
WO-2024005445-A1 METHOD FOR DEPOLYMERIZATION OF POLYMER CONTAINING ESTER FUNCTIONAL GROUP BY USING MIXTURE ORGANIC SOLVENT 한국화학연구원 2024-01-04 WO disclosed