SCHEMBL6712229

SCHEMBL6712229

C=CCC(C=O)C=CC

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
SCHEMBL8960064 1.00
SCHEMBL395365 0.80
SCHEMBL9450642 0.79
SCHEMBL1628830 0.74
SCHEMBL18730920 0.72
SCHEMBL2162560 0.72
SCHEMBL27559008 0.72
SCHEMBL2554112 0.70
SCHEMBL28813588 0.69
SCHEMBL14010945 0.68

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0543739-B1 Process for the preparation of alkyl adipates RHONE POULENC CHIMIE (FR) 1996-01-31 EP claimed
US-20040167259-A1 Method for producing aqueous copolymer dispersions of copolymers consisting of carbon monoxide and olefinically unsaturated compounds BASF AKTIENGESELLSCHAFT (DE) 2004-08-26 US disclosed
US-6670443-B1 Feeding ethylene in pulses BASF AKTIENGESELLSCHAFT (DE) 2003-12-30 US disclosed
US-6541564-B2 Copolymerization of carbon monoxide and the olefinically unsaturated carried out in an aqueous medium in the presence of metal complexes, dispersant, organic hydroxy compound, wherein the soluble macromolecular host compound BASF AKTIENGESELLSCHAFT (DE) 2003-04-01 US disclosed
US-20020198359-A1 Priparation of copolymers of carbon monoxide and an olefinically unsaturated compound in an aqueous medium BASF AKIENGESELLSCHAFT (DE) 2002-12-26 US disclosed