SCHEMBL182126

SCHEMBL182126

CCOC(=O)CC(=O)C(C)C

nearest known ligand 0.64

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
GAA P10253 2/20 0.64
MGAM O43451 1/20 0.64
SI P14410 1/20 0.64
MGAM2 Q2M2H8 1/20 0.64
ALDH1A1 P00352 4/20 0.46
TRPA1 O75762 1/20 0.46
LMNA P02545 2/20 0.41
HSD17B10 Q99714 1/20 0.40
L3MBTL1 Q9Y468 1/20 0.40
CYP1A2 P05177 1/20 0.40
ALOX15 P16050 2/20 0.39
SOAT1 P35610 1/20 0.39
KMT2A Q03164 3/20 0.38
POLB P06746 1/20 0.38
KDM4E B2RXH2 1/20 0.37
MEN1 O00255 1/20 0.37
TSHR P16473 1/20 0.37

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
SCHEMBL28825664 0.98 GAA (0.61) GAAMGAMSIMGAM2ALDH1A1
SCHEMBL28048928 0.98 GAA (0.61) GAAMGAMSIMGAM2ALDH1A1
SCHEMBL28048908 0.98 GAA (0.61) GAAMGAMSIMGAM2ALDH1A1
SCHEMBL28048925 0.98 GAA (0.61) GAAMGAMSIMGAM2ALDH1A1
SCHEMBL24023251 0.89 GAA (0.56) GAAMGAMSIMGAM2ALDH1A1
SCHEMBL9290670 0.84 GAA (0.61) GAAMGAMSIMGAM2ALDH1A1
SCHEMBL6222514 0.84 GAA (0.45) GAAMGAMSIMGAM2ALDH1A1
SCHEMBL17720258 0.82 GAA (0.58) GAAMGAMSIMGAM2ALDH1A1
SCHEMBL10185937 0.82 GAA (0.58) GAAMGAMSIMGAM2ALDH1A1
SCHEMBL17117349 0.82 GAA (0.58) GAAMGAMSIMGAM2ALDH1A1

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 1744 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-117466938-A Luminescent material, ink composition and display panel 广州华星光电半导体显示技术有限公司 2024-01-30 CN claimed
CN-113652407-B Carbonyl reductase mutant and application thereof in asymmetric synthesis of chiral compound 浙江工业大学 2024-01-16 CN claimed
CN-117019131-A Preparation method of Mg-Sr-K supported catalyst and application of catalyst in preparation of bio-based film-forming auxiliary isobutyryl ethyl acetate by ethyl acetate dehydrogenation 润泰化学(泰兴)有限公司 2023-11-10 CN claimed
CN-115555034-B Composite catalyst for converting carbonyl into methylene and preparation method for efficiently catalyzing synthesis of cholesterol by composite catalyst 湖南科瑞生物制药股份有限公司 2023-08-18 CN claimed
CN-116199623-A Preparation method of key intermediate of sorafenib 浙江科聚生物医药有限公司 2023-06-02 CN claimed
US-20230167310-A1 CURING CATALYST AND RESIN COMPOSITION KOEI CHEMICAL COMPANY, LIMITED (JP) 2023-06-01 US claimed
EP-4144436-A1 CURING CATALYST AND RESIN COMPOSITION Koei Chemical Company, Limited (JP) 2023-03-08 EP claimed
CN-115555034-A Composite catalyst for converting carbonyl into methylene and preparation method for efficiently catalyzing cholesterol synthesis by using composite catalyst 湖南科瑞生物制药股份有限公司 2023-01-03 CN claimed
CN-115461147-A Curing catalyst and resin composition 广荣化学株式会社 2022-12-09 CN claimed
CN-112899246-B Aldehyde ketone reductase KmAKR mutant and application thereof in catalytic synthesis of chiral alcohol 浙江工业大学 2022-06-21 CN claimed
CN-112778133-A high-pH-value chrome tanning auxiliary agent containing polyfunctional group structure and preparation method and application thereof 南京工业大学 2021-05-11 CN claimed
CN-112358396-A Preparation process of ethyl isobutyrylacetate 门希国 2021-02-12 CN claimed
CN-107686475-B Synthesis method of 2,3, 5-trisubstituted thiophene and derivatives thereof 湘潭大学 2020-09-25 CN claimed
CN-108084111-B Method for synthesizing amine compound containing sulfur and nitrogen heterocycles as drug intermediate 烟台宁远药业有限公司 2020-09-04 CN claimed
US-20190315892-A1 POLYMERS INCLUDING A METHYLENE BETA-KETOESTER AND PRODUCTS FORMED THEREFROM SIRRUS, INC. 2019-10-17 US claimed
US-20170355789-A1 POLYMERS INCLUDING A METHYLENE BETA-KETOESTER AND PRODUCTS FORMED THEREFROM SIRRUS, INC. 2017-12-14 US claimed
US-20170073438-A1 POLYMERS INCLUDING A METHYLENE BETA-KETOESTER AND PRODUCTS FORMED THEREFROM SIRRUS, INC. 2017-03-16 US claimed
EP-2768872-A1 METHYLENE BETA-KETOESTER MONOMERS, METHODS FOR MAKING METHYLENE BETA-KETOESTER MONOMERS, POLYMERIZABLE COMPOSITIONS AND PRODUCTS FORMED THEREFROM Bioformix LLC (US) 2014-08-27 EP claimed
WO-2013066629-A1 METHYLENE BETA-KETOESTER MONOMERS, METHODS FOR MAKING METHYLENE BETA-KETOESTER MONOMERS, POLYMERIZABLE COMPOSITIONS AND PRODUCTS FORMED THEREFROM BIOFORMIX, LLC (US) 2013-05-10 WO claimed
US-5637449-A EMULSION LAYER CONSISTS OF A PHOTOSENSITIVE SILVER HALIDE, A NON-PHOTOSENSITIVE, REDUCIBLE SILVER SOURCE, A REDUCING AGENT SYSTEM CONTAINING HINDERED PHENOL, CO-DEVELOPER, HYDROGEN ATOM DONER COMPOUND, AND A BINDER IMATION CORP (US) 1997-06-10 US claimed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (2 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20170355789-A1 POLYMERS INCLUDING A METHYLENE BETA-KETOESTER AND PRODUCTS FORMED THEREFROM BHMT2, BHMT, MACF1 GAA 2023/4885MGAM 64/4885SI 890/4885
US-20190315892-A1 POLYMERS INCLUDING A METHYLENE BETA-KETOESTER AND PRODUCTS FORMED THEREFROM BHMT2, MACF1, BHMT GAA 2252/4885MGAM 89/4885SI 1281/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.