SCHEMBL4760704

SCHEMBL4760704

O=CCCn1c(=O)n(CCC=O)c(=O)n(CCC=O)c1=O

nearest known ligand 0.39

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
CYP3A4 P08684 1/20 0.38
HIF1A Q16665 1/20 0.35
TSHR P16473 1/20 0.35
NPSR1 Q6W5P4 1/20 0.34
ALDH1A1 P00352 1/20 0.32

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
SCHEMBL10896192 0.83 APEX1 (0.50) CYP3A4
SCHEMBL11001667 0.74 CYP3A4 (0.55) CYP3A4TSHRNPSR1ALDH1A1
SCHEMBL8827010 0.72 APEX1 (0.32)
SCHEMBL17059128 0.70 GAA (0.34) CYP3A4NPSR1
SCHEMBL22338026 0.69
SCHEMBL19155603 0.67 CYP3A4 (0.46) CYP3A4TSHRNPSR1ALDH1A1
SCHEMBL17059130 0.67 CYP3A4 (0.46) CYP3A4TSHRNPSR1ALDH1A1
SCHEMBL16046697 0.66 ADORA2B (0.45) CYP3A4TSHRNPSR1ALDH1A1
SCHEMBL22899035 0.66 PDE4A (0.56) CYP3A4TSHRNPSR1ALDH1A1
SCHEMBL2463763 0.65 MGLL (0.56) NPSR1ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0055090-B1 ADDUCTS OF ACROLEIN AND ISOCYANURIC ACID AND POLYMER COMPOSITIONS THEREOF MONSANTO COMPANY (US) 1985-04-10 EP claimed
US-4375538-A Polymer compositions comprising adducts of acrolein and isocyanuric acid MONSANTO COMPANY (US) 1983-03-01 US claimed
EP-0055090-A1 Adducts of acrolein and isocyanuric acid and polymer compositions thereof MONSANTO COMPANY (US) 1982-06-30 EP claimed
US-4326057-A CROSSLINKING AGENTS MONSANTO COMPANY (US) 1982-04-20 US claimed
US-4049621-A Textile fiber EASTMAN KODAK COMPANY (US) 1977-09-20 US claimed
JP-2008158020-A POLARIZER, MANUFACTURING METHOD OF POLARIZER, AND IMAGE DISPLAY DEVICE NITTO DENKO CORP 2008-07-10 JP disclosed
EP-0082832-B1 RADIATION AND HEAT CURABLE COMPOSITIONS COMPRISING ISOCYANURIC ACID-ACROLEIN DERIVATIVES MONSANTO COMPANY (US) 1986-02-26 EP disclosed
US-4555319-A Radiation-curable compositions comprising isocyanuric acid-acrolein derivatives MONSANTO COMPANY (US) 1985-11-26 US disclosed
EP-0055091-B1 HEMIACETALS OF ADDUCTS OF ACROLEIN AND ISOCYANURIC ACID AND POLYMER COMPOSITIONS THEREOF MONSANTO COMPANY (US) 1985-07-31 EP disclosed
EP-0055092-B1 ACETALS OF ADDUCTS OF ACROLEIN AND ISOCYANURIC ACID AND POLYMER COMPOSITIONS THEREOF MONSANTO COMPANY (US) 1985-04-17 EP disclosed
EP-0055090-B1 ADDUCTS OF ACROLEIN AND ISOCYANURIC ACID AND POLYMER COMPOSITIONS THEREOF MONSANTO COMPANY (US) 1985-04-10 EP disclosed
US-4447594-A Heat-curable compositions comprising isocyanuric acid-acrolein derivatives MONSANTO COMPANY (US) 1984-05-08 US disclosed
US-4375537-A Polymer compositions comprising acetals of adducts of acrolein and isocyanuric acid MONSANTO COMPANY (US) 1983-03-01 US disclosed
US-4374240-A MOLDING MATERIALS; LAMINATION; COATINGS; ADHESIVES; CASTINGS MONSANTO COMPANY (US) 1983-02-15 US disclosed
EP-0055090-A1 Adducts of acrolein and isocyanuric acid and polymer compositions thereof MONSANTO COMPANY (US) 1982-06-30 EP disclosed
EP-0055092-A1 Acetals of adducts of acrolein and isocyanuric acid and polymer compositions thereof MONSANTO COMPANY (US) 1982-06-30 EP disclosed
EP-0055091-A1 Hemiacetals of adducts of acrolein and isocyanuric acid and polymer compositions thereof MONSANTO COMPANY (US) 1982-06-30 EP disclosed
US-4326057-A CROSSLINKING AGENTS MONSANTO COMPANY (US) 1982-04-20 US disclosed
US-4321375-A Acetals of adducts of acrolein and isocyanuric acid MONSANTO COMPANY (US) 1982-03-23 US disclosed
US-4293693-A CURING AGENTS MONSANTO COMPANY (US) 1981-10-06 US disclosed