SCHEMBL9692162

SCHEMBL9692162

COC(=O)C1OC1(C)COC(C)=O

nearest known ligand 0.35

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
ABCB1 P08183 1/20 0.35
ALDH1A1 P00352 3/20 0.32
GAA P10253 1/20 0.32
MAPT P10636 1/20 0.32
G6PD P11413 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
OPRK1 P41145 1/20 0.32
LMNA P02545 1/20 0.31
HSD17B10 Q99714 1/20 0.31
GSTP1 P09211 2/20 0.30
PRKCA P17252 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
SCHEMBL9692186 0.83 PPM1B (0.32) ALDH1A1GAAMAPT
SCHEMBL9691853 0.77 PPM1B (0.32) ALDH1A1GAAMAPTSMN1; SMN2
SCHEMBL9692233 0.71 POLA1 (0.37) SMN1; SMN2PRKCA
SCHEMBL903246 0.69
SCHEMBL9690164 0.69 POLA1 (0.44) SMN1; SMN2PRKCA
SCHEMBL10349285 0.66
SCHEMBL6839121 0.66 ABCB1 (0.47) ABCB1HSD17B10
SCHEMBL6839119 0.66 ABCB1 (0.47) ABCB1HSD17B10
SCHEMBL21694355 0.65 ABCB1 (0.49) ABCB1SMN1; SMN2LMNAHSD17B10
SCHEMBL6839079 0.65 ABCB1 (0.49) ABCB1SMN1; SMN2LMNAHSD17B10

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
EP-0153692-B1 METHOD FOR ISOMERIZATION A GLYCIDATE DERIVATIVE SAGAMI CHEMICAL RESEARCH CENTER (JP) 1992-07-29 EP disclosed
US-4621150-A METAL PERHALATE OR SULFONATE OR COMPLEX; GLYCIDATE, 2-HYDROXY-3-BUTENOATE, EPOXIDE SAGAMI CHEMICAL RESEARCH CENTER (JP) 1986-11-04 US disclosed
EP-0153692-A2 Method for isomerization a glycidate derivative SAGAMI CHEMICAL RESEARCH CENTER (JP) 1985-09-04 EP disclosed