SCHEMBL28700162

SCHEMBL28700162

CC(=O)c1c(C)ccnc1F

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NAPRT Q6XQN6 1/20 0.37
KDM4E B2RXH2 1/20 0.36
ASPH Q12797 1/20 0.36
KDM8 Q8N371 1/20 0.36
CSNK1A1 P48729 1/20 0.36
CSNK1D P48730 1/20 0.36
CLK2 P49760 1/20 0.36
CSNK1G1 Q9HCP0 1/20 0.36
CNR1 P21554 1/20 0.36
CNR2 P34972 1/20 0.36
ALDH1A1 P00352 3/20 0.35
CCR1 P32246 1/20 0.34
CCR5 P51681 1/20 0.34
CCR8 P51685 1/20 0.34
THRB P10828 1/20 0.34
NOS3 P29474 2/20 0.33
NOS2 P35228 2/20 0.33
POLB P06746 1/20 0.33
CYP2C9 P11712 1/20 0.33
CYP2C19 P33261 1/20 0.33

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
SCHEMBL17611245 0.84 NAPRT (0.46) NAPRTKDM4EASPHKDM8CNR1
SCHEMBL28018456 0.82 SIRT3 (0.43) NAPRTKDM4EASPHKDM8CNR1
SCHEMBL16414338 0.82 NAPRT (0.38) NAPRTKDM4EASPHKDM8CSNK1A1
SCHEMBL16256873 0.81 CA12 (0.42) KDM4ECNR1CNR2ALDH1A1TDP1
SCHEMBL31662998 0.79 CSNK1A1 (0.38) KDM4ECSNK1A1CSNK1DCLK2CSNK1G1
SCHEMBL6628045 0.79 CSNK1A1 (0.38) KDM4ECSNK1A1CSNK1DCLK2CSNK1G1
SCHEMBL2674661 0.78 NAPRT (0.36) NAPRTKDM4EASPHKDM8CSNK1A1
SCHEMBL27185753 0.78 CA12 (0.49) KDM4EALDH1A1SMN1; SMN2TDP1HSD17B10
Bromide SCHEMBL4181790 0.77 KDM4E (0.38) NAPRTKDM4EASPHKDM8CSNK1A1
SCHEMBL17692459 0.76 SMN1; SMN2 (0.37) KDM4ECSNK1A1CSNK1DCLK2CSNK1G1

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-114204106-B Electrolyte additive for lithium ion battery, electrolyte and lithium ion battery 松山湖材料实验室 2023-10-20 CN claimed
CN-114204106-A Lithium ion battery electrolyte additive, electrolyte and lithium ion battery 松山湖材料实验室 2022-03-18 CN claimed
CN-114204106-B Electrolyte additive for lithium ion battery, electrolyte and lithium ion battery 松山湖材料实验室 2023-10-20 CN disclosed
CN-114204106-A Lithium ion battery electrolyte additive, electrolyte and lithium ion battery 松山湖材料实验室 2022-03-18 CN disclosed