SCHEMBL29067008

SCHEMBL29067008

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

nearest known ligand 0.43

Predicted protein targets (top 8)

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 2/20 0.35
TDP1 Q9NUW8 1/20 0.35
LMNA P02545 1/20 0.30
HSD17B10 Q99714 1/20 0.30

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
SCHEMBL29067009 0.91 MGAM (0.43) MGAMGAASIMGAM2ALDH1A1
SCHEMBL5068478 0.79 MGAM (0.46) MGAMGAASIMGAM2ALDH1A1
SCHEMBL3890711 0.79 ALDH1A1 (0.40) ALDH1A1TDP1LMNAHSD17B10
SCHEMBL12504368 0.74 DGKA (0.38) ALDH1A1LMNA
SCHEMBL29067010 0.74 MGAM (0.46) MGAMGAASIMGAM2
SCHEMBL23529405 0.74 ALDH1A1 (0.40) ALDH1A1TDP1LMNAHSD17B10
SCHEMBL15514061 0.73 THRB (0.42) MGAMGAASIMGAM2ALDH1A1
SCHEMBL27622556 0.73 ALDH1A1 (0.38) MGAMGAASIMGAM2ALDH1A1
Acetic Acid SCHEMBL21330581 0.72 ALDH1A1 (0.36) ALDH1A1TDP1LMNAHSD17B10
SCHEMBL3919920 0.71 ALDH1A1 (0.38) MGAMGAASIMGAM2ALDH1A1

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