SCHEMBL28265341

SCHEMBL28265341

CCOC(=O)C(Cl)=NO.[NaH]

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.40
MAPT P10636 2/20 0.39
NPSR1 Q6W5P4 1/20 0.39
GLO1 Q04760 1/20 0.39
LMNA P02545 1/20 0.39
HSD17B10 Q99714 1/20 0.39
APOBEC3A P31941 1/20 0.39
APOBEC3G Q9HC16 1/20 0.39
TSHR P16473 1/20 0.38
ALOX15 P16050 1/20 0.37
MGAM O43451 1/20 0.37
GAA P10253 1/20 0.37
SI P14410 1/20 0.37
MGAM2 Q2M2H8 1/20 0.37
SOAT1 P35610 1/20 0.37
EGLN1 Q9GZT9 1/20 0.36
TRPA1 O75762 1/20 0.34
CYP2D6 P10635 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
ABCB1 P08183 1/20 0.34

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
SCHEMBL405356 0.98
SCHEMBL391371 0.98
SCHEMBL391370 0.98
SCHEMBL12406763 0.79
SCHEMBL9735271 0.79
SCHEMBL22840045 0.77
SCHEMBL13901633 0.77 MAPT (0.48) ALDH1A1MAPTNPSR1GLO1LMNA
SCHEMBL20204382 0.76 ALDH1A1 (0.39) ALDH1A1MAPTNPSR1GLO1LMNA
SCHEMBL16739278 0.76 ALDH1A1 (0.39) ALDH1A1MAPTNPSR1GLO1LMNA
SCHEMBL16683481 0.76 ALDH1A1 (0.39) ALDH1A1MAPTNPSR1GLO1LMNA

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-109134398-A The preparation method of high-purity ethyl demethylaminothiazolyloximate 山东金城医药化工有限公司 2019-01-04 CN disclosed