SCHEMBL29421908

SCHEMBL29421908

O=C(O)c1cc(O)cc(O)c1O

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA12 O43570 4/20 0.60
CA1 P00915 4/20 0.60
CA2 P00918 4/20 0.60
CA7 P43166 4/20 0.60
CA9 Q16790 4/20 0.60
CA14 Q9ULX7 4/20 0.60
ALDH1A1 P00352 3/20 0.60
TSHR P16473 2/20 0.60
PTGS2 P35354 2/20 0.54
ALOX5 P09917 1/20 0.54
SELL P14151 2/20 0.50
SELP P16109 2/20 0.50
MAPT P10636 3/20 0.48
HSD17B10 Q99714 3/20 0.48
HPGD P15428 3/20 0.48
KDM4E B2RXH2 2/20 0.48
LMNA P02545 1/20 0.48
TP53 P04637 1/20 0.48
CA3 P07451 1/20 0.48
FUT4 P22083 1/20 0.48

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
SCHEMBL907550 1.00 CA12 (0.60) CA12CA1CA2CA7CA9
SCHEMBL686599 0.87 CA12 (0.54) CA12CA1CA2CA7CA9
SCHEMBL21935565 0.82 NPC1 (0.48) CA12CA1CA2CA7CA9
SCHEMBL15524186 0.81 AKR1C2 (0.58) CA12CA1CA2CA7CA9
SCHEMBL22660309 0.80 CES2 (0.44) CA12CA1CA2CA7CA9
SCHEMBL2978776 0.78 MEN1 (0.56) CA12CA1CA2CA7CA9
SCHEMBL29419953 0.78 CYP3A4 (0.59) CA12CA1CA2CA7CA9
SCHEMBL2127547 0.78 CYP3A4 (0.59) CA12CA1CA2CA7CA9
SCHEMBL843251 0.78 CA12 (0.73) CA12CA1CA2CA7CA9
SCHEMBL3517151 0.77 SELL (0.58) CA12CA1CA2CA7CA9

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-119034686-A Impurity removing material and preparation method and application thereof 江苏鲁控环境科技有限公司 2024-11-29 CN claimed
CN-118878829-A Organic-inorganic hybrid, epoxy resin structural adhesive, and preparation method and application thereof 东莞市派乐玛新材料技术开发有限公司 2024-11-01 CN claimed
CN-117750886-A Salt-containing beverage with improved taste 可口可乐公司 2024-03-22 CN claimed
CN-116836081-A Ether epoxy toughening agent and preparation method and application thereof 中国林业科学研究院林产化学工业研究所 2023-10-03 CN claimed
EP-4687488-A1 SWEETNESS AND TASTE IMPROVEMENT OF NON-SUCROSE SWEETENERS WITH HYDROXYBENZOIC ACID The Coca-Cola Company (US) 2026-02-11 EP disclosed
CN-119944119-A Organic lithium supplementing agent, preparation method thereof and application thereof in positive electrode material 武汉中科先进材料科技有限公司 2025-05-06 CN disclosed
WO-2025068425-A1 METHODS FOR PRODUCING WATER-RESISTANT CHITOSAN ADHESIVE AND USES THEREOF DANMARKS TEKNISKE UNIVERSITET (DK) 2025-04-03 WO disclosed
CN-113164357-B Use of polycarboxylic acid compounds for treating fibrous substrates based on amino acids, in particular hair 迈图高新材料公司 2024-12-10 CN disclosed
CN-119034686-A Impurity removing material and preparation method and application thereof 江苏鲁控环境科技有限公司 2024-11-29 CN disclosed
CN-113166370-B Polycarboxylic acid compounds for treating fibrous substrates based on amino acids, in particular hair 迈图高新材料公司 2024-11-15 CN disclosed
CN-118878829-A Organic-inorganic hybrid, epoxy resin structural adhesive, and preparation method and application thereof 东莞市派乐玛新材料技术开发有限公司 2024-11-01 CN disclosed
WO-2024206222-A1 SWEETNESS AND TASTE IMPROVEMENT OF NON-SUCROSE SWEETENERS WITH HYDROXYBENZOIC ACID THE COCA-COLA COMPANY (US) 2024-10-03 WO disclosed
CN-117750886-A Salt-containing beverage with improved taste 可口可乐公司 2024-03-22 CN disclosed
EP-4333641-A1 BEVERAGES COMPRISING SALTS WITH IMPROVED TASTE The Coca-Cola Company (US) 2024-03-13 EP disclosed
CN-116836081-A Ether epoxy toughening agent and preparation method and application thereof 中国林业科学研究院林产化学工业研究所 2023-10-03 CN disclosed
CN-114181431-B Flame retardant, preparation method and application thereof and polyolefin composition 包头稀土研究院 2023-08-15 CN disclosed
WO-2022235772-A1 BEVERAGES COMPRISING SALTS WITH IMPROVED TASTE THE COCA-COLA COMPANY (US) 2022-11-10 WO disclosed
CN-108026279-B Asymmetrically substituted polyorganosiloxane derivatives 莫门蒂夫性能材料有限公司 2022-04-01 CN disclosed
CN-114181431-A Flame retardant, preparation method and application thereof and polyolefin composition 包头稀土研究院 2022-03-15 CN disclosed