SCHEMBL9690164

SCHEMBL9690164

CCCCCCCCC1(C)OC1C(=O)OC

nearest known ligand 0.49

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
POLA1 P09884 2/20 0.44
DNTT P04053 3/20 0.43
POLB P06746 1/20 0.43
EPHX1 P07099 1/20 0.37
TSHR P16473 1/20 0.37
HTT P42858 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
RAB9A P51151 1/20 0.36
CPT2 P23786 1/20 0.35
PRKCA P17252 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
SCHEMBL9692233 0.93 POLA1 (0.37) POLA1DNTTPOLBEPHX1TSHR
SCHEMBL9692238 0.78 ALDH1A1 (0.37) POLBRAB9A
SCHEMBL9692186 0.73 PPM1B (0.32)
SCHEMBL14967185 0.72 NAAA (0.44) EPHX1TSHRPRKCA
SCHEMBL12358905 0.71 POLA1 (0.41) POLA1DNTTPOLBTSHRHTT
SCHEMBL9692383 0.71 HTT (0.43) POLA1DNTTPOLBHTT
SCHEMBL9691800 0.71 HTT (0.43) POLA1DNTTPOLBHTT
SCHEMBL14967084 0.70 NAAA (0.42) EPHX1TSHRPRKCA
SCHEMBL28024539 0.69 SPHK1 (0.35)
SCHEMBL9692162 0.69 ABCB1 (0.35) SMN1; SMN2PRKCA

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