SCHEMBL29067009

SCHEMBL29067009

CCO[Si](CC)(OC)OC(=O)CC(C)=O

nearest known ligand 0.43

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
MGAM O43451 2/20 0.43
GAA P10253 2/20 0.43
SI P14410 2/20 0.43
MGAM2 Q2M2H8 2/20 0.43
ALDH1A1 P00352 1/20 0.31
TDP1 Q9NUW8 1/20 0.31

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
SCHEMBL29067008 0.91 MGAM (0.43) MGAMGAASIMGAM2ALDH1A1
SCHEMBL29067010 0.78 MGAM (0.46) MGAMGAASIMGAM2
SCHEMBL1608631 0.76
SCHEMBL5068478 0.75 MGAM (0.46) MGAMGAASIMGAM2ALDH1A1
Butanone SCHEMBL27882638 0.74 ALDH1A1 (0.53) MGAMGAASIMGAM2ALDH1A1
SCHEMBL29067011 0.72 MGAM (0.59) MGAMGAASIMGAM2ALDH1A1
SCHEMBL5898814 0.71
SCHEMBL1066713 0.70 MGAM (0.56) MGAMGAASIMGAM2ALDH1A1
SCHEMBL23529405 0.70 ALDH1A1 (0.40) ALDH1A1TDP1
SCHEMBL3890711 0.70 ALDH1A1 (0.40) ALDH1A1TDP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-114901725-B Polydiorganosiloxane preparation 美国陶氏有机硅公司 2023-09-08 CN disclosed