SCHEMBL28255663

SCHEMBL28255663

C=COC(C)=O.CC(F)(F)F

nearest known ligand 0.35

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.35
HSD17B10 Q99714 1/20 0.31
TDP1 Q9NUW8 1/20 0.31
TSHR P16473 1/20 0.30
GAA P10253 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
SCHEMBL28263457 0.90 ALDH1A1 (0.35) ALDH1A1HSD17B10TDP1TSHR
SCHEMBL28182390 0.90 ALDH1A1 (0.38) ALDH1A1HSD17B10TDP1TSHRGAA
Tert-Butanol SCHEMBL27539047 0.87 ALDH1A1 (0.36) ALDH1A1HSD17B10TDP1TSHRGAA
Chloromethane SCHEMBL27320408 0.87
Fluoromethane SCHEMBL27527660 0.87
SCHEMBL1438 0.87
SCHEMBL7529535 0.87 ALDH1A1 (0.44) ALDH1A1HSD17B10TDP1TSHR
Trifluoroacetic Acid SCHEMBL10404726 0.86 ALDH1A1 (0.32) ALDH1A1
SCHEMBL11752172 0.84
SCHEMBL14634943 0.84 HSD17B10 (0.32) ALDH1A1HSD17B10TDP1

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-109244534-A A kind of montmorillonite-base composite solid electrolyte and solid state lithium battery 北京科技大学 2019-01-18 CN claimed
CN-110120519-A The preparation method of the presoma of lithium-rich manganese-based anode material with stacking provisions and the lithium-rich manganese-based anode material with stacking provisions 深圳大学 2019-08-13 CN disclosed
CN-109803928-A Nickel-manganese composite hydroxide and method for producing same, positive electrode active material for nonaqueous electrolyte secondary battery and method for producing same, and nonaqueous electrolyte secondary battery 住友金属矿山株式会社 2019-05-24 CN disclosed
CN-108847501-A A kind of non-aqueous electrolyte for lithium ion cell and lithium ion battery 深圳新宙邦科技股份有限公司 2018-11-20 CN disclosed