SCHEMBL9660381

SCHEMBL9660381

COCNC(=O)OC(C)=O

nearest known ligand 0.41

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.41
TSHR P16473 2/20 0.41
HSD17B10 Q99714 1/20 0.35
TDP1 Q9NUW8 1/20 0.35
MGAM O43451 1/20 0.33
GAA P10253 1/20 0.33
SI P14410 1/20 0.33
MGAM2 Q2M2H8 1/20 0.33
EPHX1 P07099 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
SCHEMBL9075110 0.79
SCHEMBL102217 0.75
SCHEMBL1832048 0.74
SCHEMBL23921506 0.73 ALDH1A1 (0.33) ALDH1A1TSHR
SCHEMBL9075082 0.71
SCHEMBL10885575 0.71 ACHE (0.43) ALDH1A1TSHREPHX1
SCHEMBL1860919 0.71 TSHR (0.38) ALDH1A1TSHRHSD17B10MGAMGAA
SCHEMBL1965413 0.70
SCHEMBL10117371 0.70 TDP1 (0.50) TDP1GAAEPHX1
SCHEMBL7092898 0.70 ALDH1A1 (0.39) ALDH1A1TSHRHSD17B10TDP1EPHX1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
JP-4230353-A None JP disclosed
JP-H04230353-A OXALYL HYDROXAMIC ACID DERIVATIVE, AND METHOD FOR REGULATING PLANT GROWTH BASF AG 1992-08-19 JP disclosed