SCHEMBL30267487

SCHEMBL30267487

CCC(F)(F)C(=O)O.CCOC(=O)C(F)F

nearest known ligand 0.34

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.34
POLB P06746 2/20 0.33
HSD17B10 Q99714 2/20 0.33
LMNA P02545 1/20 0.33
TDP1 Q9NUW8 1/20 0.33
PIN1 Q13526 1/20 0.33
ALOX15 P16050 1/20 0.32
MGAM O43451 1/20 0.32
GAA P10253 1/20 0.32
SI P14410 1/20 0.32
MGAM2 Q2M2H8 1/20 0.32
SOAT1 P35610 1/20 0.32
TSHR P16473 2/20 0.32
SMN1; SMN2 Q16637 2/20 0.32
KDM4E B2RXH2 1/20 0.32
MEN1 O00255 1/20 0.32
NPC1 O15118 1/20 0.32
KMT2A Q03164 1/20 0.32
HCAR2 Q8TDS4 1/20 0.31
MAPT P10636 1/20 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
SCHEMBL238384 0.81
Acetic Acid SCHEMBL17748214 0.79 ALDH1A1 (0.48) ALDH1A1POLBHSD17B10LMNATDP1
Bromide SCHEMBL31026184 0.79
SCHEMBL301825 0.78
SCHEMBL29986870 0.77 GAA (0.41) ALDH1A1POLBHSD17B10LMNAALOX15
SCHEMBL5030970 0.73 MGAM (0.44) ALDH1A1POLBHSD17B10LMNATDP1
SCHEMBL30302615 0.72 MAPT (0.39) ALDH1A1POLBHSD17B10LMNATDP1
SCHEMBL1681615 0.70 CYP4F2 (0.44) ALDH1A1POLBHSD17B10LMNAPIN1
SCHEMBL3868205 0.69 ALDH1A1 (0.42) ALDH1A1POLBHSD17B10LMNAPIN1
SCHEMBL2625635 0.68 POLB (0.38) ALDH1A1POLBHSD17B10LMNAPIN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2023075362-A1 NON-AQUEOUS ELECTROLYTE FOR LITHIUM SECONDARY BATTERY, AND LITHIUM SECONDARY BATTERY COMPRISING SAME 주식회사 엘지에너지솔루션 2023-05-04 WO disclosed
WO-2023043190-A1 NON-AQUEOUS ELECTROLYTE FOR LITHIUM SECONDARY BATTERY, AND LITHIUM SECONDARY BATTERY COMPRISING SAME 주식회사 엘지에너지솔루션 2023-03-23 WO disclosed