Acetoacetic Acid

Acetoacetic Acid

SCHEMBL1406366

CC(=O)CC(=O)O.CC(=O)CC(=O)O.CC(=O)CC(=O)O.CC(=O)CC(=O)O.CC(=O)CC(=O)O.CC(=O)CC(=O)O

nearest known ligand 0.57

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LDHA P00338 1/20 0.57
SRR Q9GZT4 1/20 0.57
EGLN1 Q9GZT9 3/20 0.55
KDM4E B2RXH2 3/20 0.55
KDM5C P41229 2/20 0.55
PHF8 Q9UPP1 2/20 0.55
KDM2A Q9Y2K7 2/20 0.55
KDM6B O15054 1/20 0.55
LMNA P02545 3/20 0.50
SLC15A2 Q16348 1/20 0.50
MGAM O43451 1/20 0.47
GAA P10253 1/20 0.47
SI P14410 1/20 0.47
MGAM2 Q2M2H8 1/20 0.47
FFAR3 O14843 3/20 0.44
ALDH1A1 P00352 2/20 0.44
GLRA1 P23415 1/20 0.44
SLC6A9 P48067 1/20 0.44
OR51E2 Q9H255 1/20 0.44
TDP1 Q9NUW8 1/20 0.44

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
Acetoacetic Acid SCHEMBL21402364 1.00
Acetoacetic Acid SCHEMBL1144213 1.00 LDHA (0.57) LDHASRREGLN1KDM4EKDM5C
Acetoacetic Acid SCHEMBL653110 1.00 LDHA (0.57) LDHASRREGLN1KDM4EKDM5C
Acetoacetic Acid SCHEMBL28972036 1.00 LDHA (0.57) LDHASRREGLN1KDM4EKDM5C
Acetoacetic Acid SCHEMBL10941648 1.00 LDHA (0.57) LDHASRREGLN1KDM4EKDM5C
Acetoacetic Acid SCHEMBL6620 1.00
Acetoacetic Acid SCHEMBL649090 1.00 LDHA (0.57) LDHASRREGLN1KDM4EKDM5C
Acetoacetic Acid SCHEMBL31420005 1.00
Acetoacetic Acid SCHEMBL487189 0.96 LDHA (0.53) LDHASRREGLN1KDM4EKDM5C
Acetoacetic Acid SCHEMBL5610728 0.96

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-112638974-B Method for reducing aldehyde emissions in polyurethane foams 陶氏环球技术有限责任公司 2023-08-01 CN claimed
CN-112638974-A Method for reducing aldehyde emissions in polyurethane foams 陶氏环球技术有限责任公司 2021-04-09 CN claimed
CN-112638974-B Method for reducing aldehyde emissions in polyurethane foams 陶氏环球技术有限责任公司 2023-08-01 CN disclosed
EP-3783048-B1 A METHOD FOR APPLYING A FOAM COMPOSITION USING SPRAY FOAM EQUIPMENT HOLCIM TECHNOLOGY LTD (CH) 2023-05-10 EP disclosed
CN-115244097-A Process for reducing aldehyde emissions in polyether polyols and polyurethane foams 陶氏环球技术有限责任公司 2022-10-25 CN disclosed
CN-112638974-A Method for reducing aldehyde emissions in polyurethane foams 陶氏环球技术有限责任公司 2021-04-09 CN disclosed
EP-3783048-A1 A METHOD FOR APPLYING A FOAM COMPOSITION USING SPRAY FOAM EQUIPMENT Firestone Building Products Company, LLC (US) 2021-02-24 EP disclosed
EP-3154929-A1 FOAM COMPOSITIONS Gaco Western, LLC (US) 2017-04-19 EP disclosed
WO-2015164408-A1 FOAM COMPOSITIONS Gaco Western, LLC (US) 2015-10-29 WO disclosed
EP-1490412-B1 PHOTOINITIATOR, NOVEL COMPOUND, AND PHOTOCURABLE COMPOSITION DAINIPPON INK & CHEMICALS (JP) 2011-03-09 EP disclosed
US-7166648-B2 Photoinitiator, novel compound, and photocurable composition DAINIPPON INK AND CHEMICALS, INC. (JP) 2007-01-23 US disclosed
US-20050256218-A1 Photoinitiator, novel compound, and photocurable composition DAINIPPON INK AND CHEMICALS, INC. (JP) 2005-11-17 US disclosed
EP-1490412-A1 PHOTOINITIATOR, NOVEL COMPOUND, AND PHOTOCURABLE COMPOSITION DAINIPPON INK AND CHEMICALS, INC. (JP) 2004-12-29 EP disclosed
WO-2003082929-A1 PHOTOINITIATOR, NOVEL COMPOUND, AND PHOTOCURABLE COMPOSITION DAINIPPON INK AND CHEMICALS, INC. (JP) 2003-10-09 WO disclosed