SCHEMBL11321817

SCHEMBL11321817

CCOC(=O)ON=C(C(=O)OCC)C(=O)OCC

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 6/20 0.50
SOAT1 P35610 1/20 0.46
MAPT P10636 3/20 0.42
ALOX15 P16050 1/20 0.41
NPSR1 Q6W5P4 1/20 0.38
GLO1 Q04760 1/20 0.38
LMNA P02545 2/20 0.37
HSD17B10 Q99714 1/20 0.37
ABCB1 P08183 1/20 0.37
TSHR P16473 1/20 0.36
MEN1 O00255 3/20 0.36
KMT2A Q03164 3/20 0.36
MGAM O43451 1/20 0.36
GAA P10253 1/20 0.36
SI P14410 1/20 0.36
MGAM2 Q2M2H8 1/20 0.36
EGLN1 Q9GZT9 1/20 0.35
PLIN1 O60240 1/20 0.34
POLB P06746 1/20 0.34
PLIN5 Q00G26 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
SCHEMBL10744655 0.83 MAPT (0.37) ALDH1A1SOAT1MAPTALOX15NPSR1
SCHEMBL8411151 0.83 ALDH1A1 (0.48) ALDH1A1SOAT1MAPTALOX15NPSR1
SCHEMBL21752093 0.81 ALDH1A1 (0.48) ALDH1A1SOAT1MAPTALOX15NPSR1
SCHEMBL21752092 0.81 ALDH1A1 (0.48) ALDH1A1SOAT1MAPTALOX15NPSR1
SCHEMBL21769828 0.81 ALDH1A1 (0.48) ALDH1A1SOAT1MAPTALOX15NPSR1
SCHEMBL11329782 0.81 ALOX15 (0.39) ALDH1A1SOAT1MAPTALOX15NPSR1
SCHEMBL11960268 0.79 ALDH1A1 (0.44) ALDH1A1MAPTNPSR1LMNAMEN1
SCHEMBL4836138 0.77 ALDH1A1 (0.42) ALDH1A1SOAT1MAPTALOX15NPSR1
SCHEMBL8205738 0.77 ALDH1A1 (0.55) ALDH1A1SOAT1MAPTALOX15GLO1
SCHEMBL8298480 0.77 ALDH1A1 (0.55) ALDH1A1SOAT1MAPTALOX15LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-RE30752-E CHEMICAL REACTANT FOR PROTECTING AMINO OR IMINO GROUPS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1981-09-29 US disclosed
US-4010178-A Carbonic acid esters, and the preparation thereof and their use FUJISAWA PHARMACEUTICAL CO., LTD. (JA) 1977-03-01 US disclosed
US-3976635-A Novel esterifying agents, and their production and use FUJISAWA PHARMACEUTICAL CO., LTD. (JA) 1976-08-24 US disclosed