Acetoacetic Acid

Acetoacetic Acid

SCHEMBL3094644

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

nearest known ligand 0.50

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.50
KDM5C P41229 2/20 0.50
EGLN1 Q9GZT9 2/20 0.50
PHF8 Q9UPP1 2/20 0.50
KDM2A Q9Y2K7 2/20 0.50
LDHA P00338 1/20 0.50
SRR Q9GZT4 1/20 0.50
KDM6B O15054 1/20 0.50
FFAR3 O14843 3/20 0.47
ALDH1A1 P00352 3/20 0.47
TDP1 Q9NUW8 3/20 0.47
LMNA P02545 1/20 0.45
SLC15A2 Q16348 1/20 0.45
MGAM O43451 1/20 0.43
GAA P10253 1/20 0.43
SI P14410 1/20 0.43
MGAM2 Q2M2H8 1/20 0.43
HDAC3 O15379 1/20 0.40
HDAC1 Q13547 1/20 0.40
HDAC2 Q92769 1/20 0.40

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 SCHEMBL653110 0.93 LDHA (0.57) KDM4EKDM5CEGLN1PHF8KDM2A
Acetoacetic Acid SCHEMBL649090 0.93 LDHA (0.57) KDM4EKDM5CEGLN1PHF8KDM2A
Acetoacetic Acid SCHEMBL1144213 0.93 LDHA (0.57) KDM4EKDM5CEGLN1PHF8KDM2A
Acetoacetic Acid SCHEMBL6620 0.93
Acetoacetic Acid SCHEMBL1406366 0.93 LDHA (0.57) KDM4EKDM5CEGLN1PHF8KDM2A
Acetoacetic Acid SCHEMBL28972036 0.93 LDHA (0.57) KDM4EKDM5CEGLN1PHF8KDM2A
Acetoacetic Acid SCHEMBL31420005 0.93
Acetoacetic Acid SCHEMBL10941648 0.93 LDHA (0.57) KDM4EKDM5CEGLN1PHF8KDM2A
Acetoacetic Acid SCHEMBL21402364 0.93
Acetoacetic Acid SCHEMBL28972476 0.90 KDM4E (0.48) KDM4EKDM5CEGLN1PHF8KDM2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6765056-B2 ALDEHYDE-FUNCTIONAL POLYURETHANE COMPRISING DISPERSING GROUPS, AND A LOW MOLECULAR WEIGHT ALDEHYDE-REACTIVE CROSSLINKER SELECTED FROM POLYAMINES AND CYANO, SULFO, KETO-, PHOSPHONO, OR NITRO-FUNCTIONAL COMPOUNDS; REFINISHING CARS AKZO NOBEL N.V. (NL) 2004-07-20 US claimed
US-20040029991-A1 UV curable oligomeric adhesive compositions suitable for use in flexible packaging applications ARKEMA FRANCE (FR) 2004-02-12 US claimed
EP-3746494-B1 POLYURETHANES WITH LOW EMISSIONS OF ORGANIC COMPOUNDS BASF SE (DE) 2024-05-29 EP disclosed
CN-113366069-B Binder for aqueous coating compositions 湛新奥地利有限公司 2023-04-21 CN disclosed
CN-111566139-B Phenolic resin binder with reduced formaldehyde content ASK化学品股份有限公司 2022-07-08 CN disclosed
CN-111566139-A Phenolic resin binder with reduced formaldehyde content ASK化学品股份有限公司 2020-08-21 CN disclosed
US-10040900-B2 Thermosetting resin composition AKZO NOBEL CHEMICALS INTERNATIONAL B.V. (NL) 2018-08-07 US disclosed
EP-2920235-B1 THERMOSETTING RESIN COMPOSITION DSM IP ASSETS BV (NL) 2016-12-21 EP disclosed
EP-2865701-B1 Reactive multi-functional additives for coatings compositions ROHM & HAAS (US) 2016-08-24 EP disclosed
US-20150291734-A1 THERMOSETTING RESIN COMPOSITION WILMINGTON TRUST (LONDON) LIMITED, AS COLLATERAL AGENT (GB) 2015-10-15 US disclosed
EP-2920235-A1 THERMOSETTING RESIN COMPOSITION DSM IP Assets B.V. (NL) 2015-09-23 EP disclosed
EP-1280842-A1 AQUEOUS TWO-COMPONENT CROSS-LINKABLE COMPOSITION Akzo Nobel N.V. (NL) 2003-02-05 EP disclosed
EP-0828797-B1 ORGANIC SOLVENT-CONTAINING COATING COMPOSITION COMPRISING POLYACETOACETATE, CROSSLINKER AND ORGANOSILANE AKZO NOBEL NV (NL) 2002-07-24 EP disclosed
WO-2001077202-A1 AQUEOUS TWO-COMPONENT CROSS-LINKABLE COMPOSITION AKZO NOBEL N.V. (NL) 2001-10-18 WO disclosed
EP-0828798-B1 COATING COMPOSITION HAVING IMPROVED ADHESION TO SUBSTRATE AD AEROSPACE FINISHES VOF (NL) 2001-08-22 EP disclosed
US-6203607-B1 BONDING STRENGTH AKZO NOBEL N.V. (NL) 2001-03-20 US disclosed
EP-0828798-A1 COATING COMPOSITION HAVING IMPROVED ADHESION TO SUBSTRATE AD Aerospace Finishes v.o.f. (NL) 1998-03-18 EP disclosed
EP-0828797-A2 COATING COMPOSITION COMPRISING POLYACETOACETATE, CROSSLINKER AND ORGANOSILANE AD Aeorospace Finishes V.O.F. (NL) 1998-03-18 EP disclosed
US-5147925-A Chain extension; chemical, corrosion, wear resistance IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1992-09-15 US disclosed
EP-0442652-A2 Production of polyurethane polymers the polymers so produced and compositions containing them ZENECA LIMITED (GB) 1991-08-21 EP disclosed