Acetoacetic Acid

Acetoacetic Acid

SCHEMBL6022244

CC(=O)CC(=O)O.CC(=O)CC(=O)O.CC(=O)CC(=O)O.CC(=O)CC(=O)O.CCC(CO)(CO)CO

nearest known ligand 0.38

Full drug profile on Sugi Atlas →

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.38
KDM6B O15054 1/20 0.38
KDM5C P41229 1/20 0.38
EGLN1 Q9GZT9 1/20 0.38
PHF8 Q9UPP1 1/20 0.38
KDM2A Q9Y2K7 1/20 0.38
LDHA P00338 1/20 0.35
SRR Q9GZT4 1/20 0.35
FFAR3 O14843 1/20 0.33
LMNA P02545 1/20 0.33
SLC15A2 Q16348 1/20 0.33
ALDH1A1 P00352 1/20 0.33
TDP1 Q9NUW8 1/20 0.33
MGAM O43451 1/20 0.32
GAA P10253 1/20 0.32
SI P14410 1/20 0.32
MGAM2 Q2M2H8 1/20 0.32
PKM P14618 1/20 0.31
HTT P42858 1/20 0.30

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 SCHEMBL7708376 1.00 KDM4E (0.38) KDM4EKDM6BKDM5CEGLN1PHF8
Acetoacetic Acid SCHEMBL649054 1.00 KDM4E (0.38) KDM4EKDM6BKDM5CEGLN1PHF8
Acetoacetic Acid SCHEMBL8999876 1.00 KDM4E (0.38) KDM4EKDM6BKDM5CEGLN1PHF8
Acetoacetic Acid SCHEMBL651230 1.00 KDM4E (0.38) KDM4EKDM6BKDM5CEGLN1PHF8
Acetoacetic Acid SCHEMBL29096367 0.89 PLA2G2C (0.33) KDM4EKDM6BKDM5CEGLN1PHF8
Acetoacetic Acid SCHEMBL17746200 0.88 KDM4E (0.42) KDM4EKDM6BKDM5CEGLN1PHF8
Acetoacetic Acid SCHEMBL17746194 0.88 KDM4E (0.42) KDM4EKDM6BKDM5CEGLN1PHF8
Acetoacetic Acid SCHEMBL649063 0.88 KDM4E (0.42) KDM4EKDM6BKDM5CEGLN1PHF8
Acetoacetic Acid SCHEMBL17746185 0.88 KDM4E (0.42) KDM4EKDM6BKDM5CEGLN1PHF8
Acetoacetic Acid SCHEMBL649819 0.88 KDM4E (0.42) KDM4EKDM6BKDM5CEGLN1PHF8

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-113438992-A Isocyanate-free adhesives 隆萨解决方案股份公司 2021-09-24 CN claimed
CN-114096510-A Process for preparing acetoacetate compounds 阿尔萨达股份公司 2022-02-25 CN disclosed
CN-113438992-A Isocyanate-free adhesives 隆萨解决方案股份公司 2021-09-24 CN disclosed
EP-1578824-B8 CURABLE LIQUID ACRYLOYL GROUP CONTAINING RESIN COMPOSITION DAINIPPON INK & CHEMICALS (JP) 2006-11-15 EP disclosed
EP-1578824-A1 CURABLE LIQUID ACRYLOYL GROUP CONTAINING RESIN COMPOSITION DAINIPPON INK AND CHEMICALS, INC. (JP) 2005-09-28 EP disclosed
WO-2004056897-A1 CURABLE LIQUID ACRYLOYL GROUP CONTAINING RESIN COMPOSITION DAINIPPON INK AND CHEMICALS, INC. (JP) 2004-07-08 WO disclosed