SCHEMBL11568466

SCHEMBL11568466

CCCOC(=O)C(=NO)C(C)(C)C

nearest known ligand 0.38

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
HCAR2 Q8TDS4 1/20 0.34
ALDH1A1 P00352 6/20 0.33
GAA P10253 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
TSHR P16473 3/20 0.32
LMNA P02545 2/20 0.32
ESR1 P03372 1/20 0.32
CHRM1 P11229 1/20 0.32
SLC6A2 P23975 1/20 0.32
KDR P35968 1/20 0.32
TDP1 Q9NUW8 1/20 0.32
NAAA Q02083 1/20 0.31
DGKA P23743 1/20 0.31
RAD52 P43351 1/20 0.31
NPSR1 Q6W5P4 1/20 0.31
RAB9A P51151 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
SCHEMBL138475 0.78 HCAR2 (0.48) HCAR2ALDH1A1GAASMN1; SMN2TSHR
Water SCHEMBL27557216 0.75 HCAR2 (0.46) HCAR2ALDH1A1GAASMN1; SMN2TSHR
SCHEMBL26327321 0.74 HCAR2 (0.39) HCAR2ALDH1A1GAASMN1; SMN2TSHR
SCHEMBL2992405 0.72 HCAR2 (0.38) HCAR2ALDH1A1GAASMN1; SMN2TSHR
SCHEMBL11568057 0.72 TET2 (0.38) ALDH1A1TSHR
SCHEMBL11572544 0.72 TET2 (0.38) ALDH1A1TSHR
SCHEMBL15913473 0.71 GAA (0.39) HCAR2ALDH1A1GAASMN1; SMN2TSHR
SCHEMBL17219833 0.71 HCAR2 (0.36) HCAR2ALDH1A1GAASMN1; SMN2TSHR
SCHEMBL27438786 0.71 TSHR (0.42) HCAR2ALDH1A1GAASMN1; SMN2TSHR
SCHEMBL1977993 0.71 ALDH1A1 (0.48) HCAR2ALDH1A1GAASMN1; SMN2TSHR

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
EP-0003301-A1 N-Sulfenyl-carbamoyl-oximes, preparation thereof and use thereof as insecticides, acaricides, nematocides BAYER AG (DE) 1979-08-08 EP disclosed