SCHEMBL28404642

SCHEMBL28404642

CC(C)OC(=O)CC(F)(F)F

nearest known ligand 0.42

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
LMNA P02545 3/20 0.42
TSHR P16473 3/20 0.40
SMN1; SMN2 Q16637 1/20 0.36
MAPT P10636 2/20 0.35
CYP2D6 P10635 2/20 0.34
HTT P42858 2/20 0.33
ALDH1A1 P00352 2/20 0.33
HCAR2 Q8TDS4 1/20 0.32
PTPN1 P18031 1/20 0.32
NPSR1 Q6W5P4 2/20 0.31
L3MBTL1 Q9Y468 1/20 0.31
NLRP3 Q96P20 1/20 0.31
CYP1A2 P05177 1/20 0.30
CYP3A4 P08684 1/20 0.30
CYP2C9 P11712 1/20 0.30
CYP2C19 P33261 1/20 0.30
AGTR1 P30556 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
SCHEMBL22086837 0.80 LMNA (0.38) LMNATSHRSMN1; SMN2MAPTCYP2D6
SCHEMBL22086838 0.80 LMNA (0.38) LMNATSHRSMN1; SMN2MAPTCYP2D6
SCHEMBL22086924 0.79 LMNA (0.37) LMNATSHRSMN1; SMN2MAPTCYP2D6
SCHEMBL4002605 0.78 LMNA (0.43) LMNATSHRSMN1; SMN2MAPTCYP2D6
SCHEMBL1219372 0.77 KDM4E (0.30) ALDH1A1
SCHEMBL8133987 0.76 LMNA (0.42) LMNATSHRSMN1; SMN2MAPTCYP2D6
SCHEMBL28166421 0.76 LMNA (0.42) LMNATSHRSMN1; SMN2MAPTCYP2D6
SCHEMBL26339931 0.76 HTT (0.33) HTT
SCHEMBL8851434 0.74 LMNA (0.41) LMNATSHRSMN1; SMN2MAPTCYP2D6
SCHEMBL10081207 0.74 LMNA (0.41) LMNATSHRSMN1; SMN2MAPTCYP2D6

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-114665154-A Electrolyte containing fluorine solvent and pyrazole additive 上海瑞浦青创新能源有限公司 2022-06-24 CN claimed
CN-111129664-A Lithium ion battery electrolyte and lithium ion battery thereof 杉杉新材料(衢州)有限公司 2020-05-08 CN claimed
CN-114665154-A Electrolyte containing fluorine solvent and pyrazole additive 上海瑞浦青创新能源有限公司 2022-06-24 CN disclosed
CN-111129664-A Lithium ion battery electrolyte and lithium ion battery thereof 杉杉新材料(衢州)有限公司 2020-05-08 CN disclosed