SCHEMBL4451570

SCHEMBL4451570

C=COC(C)=O.CCC=C(C)C(=O)OOC(=O)CC(C)=O

nearest known ligand 0.32

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
MGAM O43451 1/20 0.32
GAA P10253 1/20 0.32
SI P14410 1/20 0.32
MGAM2 Q2M2H8 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
SCHEMBL216581 0.87 MGAM (0.41) MGAMGAASIMGAM2
SCHEMBL630011 0.87 MGAM (0.41) MGAMGAASIMGAM2
SCHEMBL20357806 0.87 MGAM (0.41) MGAMGAASIMGAM2
Acetaldehyde SCHEMBL4451567 0.82
SCHEMBL7117658 0.76 MGAM (0.38) MGAMGAASIMGAM2
SCHEMBL28813485 0.75 MGAM (0.46) MGAMGAASIMGAM2
SCHEMBL3961508 0.75 CYP2D6 (0.31)
SCHEMBL2205795 0.74 MGAM (0.39) MGAMGAASIMGAM2
SCHEMBL7794966 0.74 GRIK1 (0.31)
SCHEMBL6935317 0.73 ALDH1A1 (0.33)

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
US-7612126-B2 Low-VOC aqueous coating compositions with excellent freeze-thaw stability BASF AKTIENGESELLSCHAFT (DE) 2009-11-03 US disclosed
US-20070105982-A1 Low-voc aqueous coating compositions with excellent freeze-thaw stability BASF AKTIENGESELLSCHAFT (DE) 2007-05-10 US disclosed
EP-1692237-A1 LOW-VOC AQUEOUS COATING COMPOSITIONS WITH EXCELLENT FREEZE-THAW STABILITY BASF AKTIENGESELLSCHAFT (DE) 2006-08-23 EP disclosed
WO-2005054384-A1 LOW-VOC AQUEOUS COATING COMPOSITIONS WITH EXCELLENT FREEZE-THAW STABILITY BASF AKTIENGESELLSCHAFT (DE) 2005-06-16 WO disclosed
EP-1541648-A1 Low-voc aqueous coating compositions with excellent freeze-thaw stability BASF AKTIENGESELLSCHAFT (DE) 2005-06-15 EP disclosed