SCHEMBL697309

SCHEMBL697309

CC1(CO)C=CC(=O)O1

nearest known ligand 0.00

⚠ Novel chemotype — no close known analogue (best Tanimoto < 0.3). Unexplored chemical space relative to ChEMBL.

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
SCHEMBL8824459 0.82
SCHEMBL8562287 0.75 GABRP (0.37)
SCHEMBL30106809 0.74 ALOX5 (0.53)
SCHEMBL29152248 0.73
SCHEMBL165533 0.71
SCHEMBL3834814 0.70
SCHEMBL31589977 0.69 KDM4E (0.45)
SCHEMBL18529174 0.67
SCHEMBL11793403 0.67
SCHEMBL31590295 0.66 L3MBTL1 (0.49)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2423205-B9 Conversion of carbohydrates to hydroxymethylfurfural (HMF) and derivatives ARCHER DANIELS MIDLAND CO (US) 2020-03-18 EP claimed
EP-2423205-B2 Conversion of carbohydrates to hydroxymethylfurfural (HMF) and derivatives ARCHER DANIELS MIDLAND CO (US) 2019-09-18 EP claimed
EP-2423205-B1 Conversion of carbohydrates to hydroxymethylfurfural (HMF) and derivatives ARCHER DANIELS MIDLAND CO (US) 2016-10-19 EP claimed
EP-2944632-A1 OXIDATION OF A MIXTURE OF 2-HYDROXYMETHYL-5-FURFURALDEHYDE (HMF) AND AN ESTER THEREOF TO 2,5-FURANDICARBOXYLIC ACID (FDCA) Archer Daniels Midland Co. (US) 2015-11-18 EP claimed
EP-2762470-A1 Conversion of carbohydrates to hydroxymethylfurfural (HMF) and derivatives Archer-Daniels-Midland Company (US) 2014-08-06 EP claimed
EP-2423205-A1 Conversion of carbohydrates to hydroxymethylfurfural (HMF) and derivatives Archer-Daniels-Midland Company (US) 2012-02-29 EP claimed
CN-118112155-A Method for tracing type of brown lactobacillus beverage and analyzing volatile flavor components of brown lactobacillus beverage 内蒙古伊利实业集团股份有限公司 2024-05-31 CN disclosed
CN-111825843-B Method for synthesizing partially renewable polysiloxanes by catalytic dehydrogenation coupling of ionic iridium complex 中国科学院大连化学物理研究所 2021-08-31 CN disclosed
CN-106795130-B Catalyst and process for the production of 2,5-furandicarboxylic acid from hydroxymethylfurfural in water 阿彻丹尼尔斯米德兰德公司 2021-01-22 CN disclosed
CN-111825843-A Method for synthesizing partially renewable polysiloxanes by catalytic dehydrogenation coupling of ionic iridium complex 中国科学院大连化学物理研究所 2020-10-27 CN disclosed
EP-2423205-B9 Conversion of carbohydrates to hydroxymethylfurfural (HMF) and derivatives ARCHER DANIELS MIDLAND CO (US) 2020-03-18 EP disclosed
EP-2423205-B2 Conversion of carbohydrates to hydroxymethylfurfural (HMF) and derivatives ARCHER DANIELS MIDLAND CO (US) 2019-09-18 EP disclosed
US-10316009-B2 Process to prepare hydroxymethylfurfural derivatives GFBIOCHEMICALS IP ASSETS B.V. (NL) 2019-06-11 US disclosed
CN-101720320-A Use the method for non-functional polymer resin purifying hydroxymethyl furfural ARCHER DANIELS MIDLAND CO 2010-06-02 CN disclosed
WO-2009076627-A2 CONVERSION OF CARBOHYDRATES TO HYDROXY-METHYLFURFURAL (HMF) AND DERIVATIVES ARCHER DANIELS MIDLAND CO (US) 2009-06-18 WO disclosed
US-20090156841-A1 CONVERSION OF CARBOHYDRATES TO HYDROXYMETHYLFURFURAL (HMF) AND DERIVATIVES ARCHER DANIELS MIDLAND CO. 2009-06-18 US disclosed
US-20090030215-A1 METHOD FOR PRODUCTION OF 5-HYDROXYMETHYL-2-FURFURAL FROM FRUCTOSE DIGNAN CHRISTINE 2009-01-29 US disclosed
WO-2009012445-A1 METHOD FOR PRODUCTION OF 5-HYDROXYMETHYL-2-FURFURAL FROM FRUCTOSE ARCHER DANIELS MIDLAND COMPANY (US) 2009-01-22 WO disclosed
US-20090018352-A1 Method for purifying hydroxymethylfurfural using non-functional polymeric resins ARCHER DANIELS MIDLAND COMPANY 2009-01-15 US disclosed
WO-2008157617-A1 METHOD FOR PURIFYING HYDROXYMETHYL-FURFURAL USING NON-FUNCTIONAL POLYMERIC RESINS ARCHER DANIELS-MIDLAND COMPANY (US) 2008-12-24 WO disclosed