SCHEMBL28653583

SCHEMBL28653583

CCOC(=O)CC1(C(C)=O)C=CC=CC1

nearest known ligand 0.37

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 1/20 0.37
L3MBTL1 Q9Y468 1/20 0.37
GAA P10253 2/20 0.34
MGAM O43451 1/20 0.34
SI P14410 1/20 0.34
MGAM2 Q2M2H8 1/20 0.34
CTDSP1 Q9GZU7 1/20 0.33
ALDH1A1 P00352 2/20 0.32
TRPA1 O75762 1/20 0.32
LMNA P02545 1/20 0.31
HSD17B10 Q99714 1/20 0.31
ALOX15 P16050 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
SCHEMBL28244218 0.78
SCHEMBL6104206 0.78 KMT2A (0.39) KMT2AL3MBTL1GAAMGAMSI
SCHEMBL27813859 0.76 ALDH1A1 (0.37) KMT2AL3MBTL1GAAMGAMSI
SCHEMBL11582266 0.73
Acetonitrile SCHEMBL28745506 0.71
SCHEMBL1131345 0.70 MAPK1 (0.35)
SCHEMBL5188246 0.69 GAA (0.44) KMT2AL3MBTL1GAAMGAMSI
SCHEMBL13157265 0.68 POLB (0.34) KMT2AGAAMGAMSIMGAM2
SCHEMBL29033483 0.68 GAA (0.37) KMT2AL3MBTL1GAAMGAMSI
SCHEMBL8941731 0.67

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-108623529-B Preparation method of oxaziclomefone 山东先达农化股份有限公司 2021-11-26 CN disclosed