SCHEMBL18890

SCHEMBL18890

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

nearest known ligand 0.61

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
GAA P10253 2/20 0.61
MGAM O43451 1/20 0.61
SI P14410 1/20 0.61
MGAM2 Q2M2H8 1/20 0.61
ALDH1A1 P00352 4/20 0.44
TRPA1 O75762 1/20 0.44
L3MBTL1 Q9Y468 1/20 0.39
CES2 O00748 1/20 0.39
CYP1A2 P05177 1/20 0.39
LMNA P02545 2/20 0.39
HSD17B10 Q99714 1/20 0.39
ALOX15 P16050 1/20 0.37
SOAT1 P35610 1/20 0.37
KMT2A Q03164 3/20 0.37
POLB P06746 2/20 0.37
KDM4E B2RXH2 1/20 0.36
MEN1 O00255 1/20 0.36

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
SCHEMBL29010309 0.98 GAA (0.58) GAAMGAMSIMGAM2ALDH1A1
Silver SCHEMBL30466756 0.98 GAA (0.58) GAAMGAMSIMGAM2ALDH1A1
SCHEMBL17275135 0.98 GAA (0.58) GAAMGAMSIMGAM2ALDH1A1
SCHEMBL17275136 0.96 GAA (0.56) GAAMGAMSIMGAM2ALDH1A1
SCHEMBL25711754 0.90 GAA (0.54) GAAMGAMSIMGAM2ALDH1A1
SCHEMBL17275156 0.86 GAA (0.45) GAAMGAMSIMGAM2ALDH1A1
SCHEMBL1891371 0.84 GAA (0.58) GAAMGAMSIMGAM2ALDH1A1
SCHEMBL28924679 0.83 CES2 (0.41) GAAMGAMSIMGAM2ALDH1A1
SCHEMBL7096992 0.83 GAA (0.56) GAAMGAMSIMGAM2ALDH1A1
SCHEMBL16481526 0.83 GAA (0.56) 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 1087 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-119930595-A Synthetic process of isoxazoline derivative 江苏剑牌农化股份有限公司 2025-05-06 CN claimed
CN-119882351-A High-adhesion positive KrF photoresist resin composition 万华化学集团股份有限公司 2025-04-25 CN claimed
CN-119101010-B Difluoromethyl thiazole amide-containing compound and application thereof as bactericide 安徽理工大学 2025-04-04 CN claimed
CN-119591545-A Synthesis method of difluoro pyrazole acid and ester and intermediate thereof 湖北晟康化工有限公司 2025-03-11 CN claimed
CN-118702572-A Synthesis method of ethyl 2-ethoxymethylene-4, 4-difluoro-3-oxobutyrate 苏利(宁夏)新材料科技有限公司 2024-09-27 CN claimed
CN-114315577-B Synthesis method of 2-ethoxymethylene-4, 4-difluoro acetoacetic acid ethyl ester 湖南海利化工股份有限公司 2024-09-13 CN claimed
CN-118420467-B Method for separating methyl acetate/ethyl acetate-methanol/ethanol-water mixed solution by using NMP waste liquid 湖南工程学院 2024-08-30 CN claimed
CN-118420467-A Method for separating methyl acetate/ethyl acetate-methanol/ethanol-water mixed solution by using NMP waste liquid 湖南工程学院 2024-08-02 CN claimed
CN-118063317-B Preparation method of 4, 4-difluoro acetoacetic acid ethyl ester 江西农业大学 2024-06-21 CN claimed
CN-118063317-A Preparation method of 4, 4-difluoro acetoacetic acid ethyl ester 江西农业大学 2024-05-24 CN claimed
CN-107876092-A The high stability titanium catalyst of ester exchange carbonate synthesis benzene methyl and diphenyl carbonate 华东理工大学 2018-04-06 CN claimed
CN-107501182-A The trifluoromethyl of 1 substituted-phenyl 5(Difluoromethyl)4 pyrazole carboxylic acid synthetic methods 中国农业大学 2017-12-22 CN claimed
CN-107417719-A A kind of titanium chelate catalyst for being used for carbonate synthesis benzene methyl and diphenyl carbonate 华东理工大学 2017-12-01 CN claimed
EP-2571854-B1 METHOD FOR MANUFACTURING 1-ALKYL-3-DIFLUORMETHYL-5-HYDROXYPYRAZOLES BAYER IP GMBH (DE) 2014-11-05 EP claimed
US-8455664-B2 Process for preparing 1-alkyl-3-difluoromethyl-5-hydroxypyrazoles BAYER CROPSCIENCE AG (DE) 2013-06-04 US claimed
EP-2571854-A1 METHOD FOR MANUFACTURING 1 - ALKYL - 3 - DIFLUORMETHYL - 5 - HYDROXYPYRAZOLES Bayer Intellectual Property GmbH (DE) 2013-03-27 EP claimed
US-20110288304-A1 Process for Preparing 1-Alkyl-3-difluoromethyl-5-hydroxypyrazoles BAYER CROPSCIENCE AG (DE) 2011-11-24 US claimed
WO-2011144549-A1 METHOD FOR MANUFACTURING 1 - ALKYL - 3 - DIFLUORMETHYL - 5 - HYDROXYPYRAZOLES BAYER CROPSCIENCE AG (DE) 2011-11-24 WO claimed
EP-0135491-B1 HERBICIDAL 2,6-BIS-FLUOROMETHYL-DIHYDROPYRIDINE-3,5-DICARBOXYLIC ACID ESTERS MONSANTO COMPANY (US) 1989-01-25 EP claimed
EP-0135491-A1 Herbicidal 2,6-bis-fluoromethyl-dihydropyridine-3,5-dicarboxylic acid esters MONSANTO COMPANY (US) 1985-03-27 EP 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 (1 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-20110288304-A1 Process for Preparing 1-Alkyl-3-difluoromethyl-5-hydroxypyrazoles CYP51A1, CYP3A5, CYP4F3 GAA 507/4885MGAM 278/4885SI 667/4885

“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.