SCHEMBL28008641

SCHEMBL28008641

O=C(CF)OC(=O)CC(=O)OC(=O)CF

nearest known ligand 0.35

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
MGAM O43451 1/20 0.35
GAA P10253 1/20 0.35
SI P14410 1/20 0.35
MGAM2 Q2M2H8 1/20 0.35
ALDH1A1 P00352 1/20 0.35
CASP1 P29466 1/20 0.33
TSHR P16473 1/20 0.32

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
SCHEMBL777793 0.90
SCHEMBL26103597 0.87 ALDH1A1 (0.38) ALDH1A1CASP1
Fluoride SCHEMBL17509880 0.87 ALDH1A1 (0.38) ALDH1A1CASP1
Cyclohexane SCHEMBL29109128 0.81 ALDH1A1 (0.35) ALDH1A1CASP1
Acetic Acid SCHEMBL28992498 0.79 FFAR3 (0.41) MGAMGAASIMGAM2ALDH1A1
SCHEMBL776379 0.79
SCHEMBL25283572 0.77 ALDH1A1 (0.43) ALDH1A1CASP1
SCHEMBL28421116 0.77
SCHEMBL10798173 0.73 CASP1 (0.32) CASP1
SCHEMBL776377 0.73

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-105130593-A Sodium alginate oligosaccharide complex and applications of sodium alginate oligosaccharide complex in release of copper toxicity on crops INST PLANT NUTITUION & RESOURCE ENVIRONMENT HENAN ACADEMY AGRICULTURAL SCIENCES 2015-12-09 CN claimed
CN-104649807-A Chitosan oligosaccharide compound and application of chitosan oligosaccharide compound in relieving albino seedling of graminaceous crops DALIAN CHEMICAL PHYSICS INST 2015-05-27 CN claimed
CN-105130593-A Sodium alginate oligosaccharide complex and applications of sodium alginate oligosaccharide complex in release of copper toxicity on crops INST PLANT NUTITUION & RESOURCE ENVIRONMENT HENAN ACADEMY AGRICULTURAL SCIENCES 2015-12-09 CN disclosed
CN-104649807-A Chitosan oligosaccharide compound and application of chitosan oligosaccharide compound in relieving albino seedling of graminaceous crops DALIAN CHEMICAL PHYSICS INST 2015-05-27 CN disclosed