SCHEMBL9692233

SCHEMBL9692233

CCCCC1(C)OC1C(=O)OC

nearest known ligand 0.40

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
POLA1 P09884 2/20 0.37
DNTT P04053 3/20 0.36
POLB P06746 1/20 0.36
SMN1; SMN2 Q16637 2/20 0.33
RAB9A P51151 1/20 0.33
TSHR P16473 1/20 0.33
HTT P42858 1/20 0.33
EPHX1 P07099 1/20 0.32
BCHE P06276 1/20 0.31
PRKCA P17252 2/20 0.31

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
SCHEMBL9690164 0.93 POLA1 (0.44) POLA1DNTTPOLBSMN1; SMN2RAB9A
SCHEMBL9692238 0.84 ALDH1A1 (0.37) POLBRAB9A
SCHEMBL9691853 0.81 PPM1B (0.32) SMN1; SMN2TSHR
SCHEMBL3673205 0.79
SCHEMBL9692186 0.76 PPM1B (0.32)
SCHEMBL9692162 0.71 ABCB1 (0.35) SMN1; SMN2PRKCA
SCHEMBL13791362 0.70 TRPA1 (0.38)
SCHEMBL14967933 0.70 ALDH1A1 (0.42) POLBSMN1; SMN2TSHREPHX1PRKCA
SCHEMBL903246 0.69
SCHEMBL27861186 0.68

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