Methyl 4-Pyridylketone

Methyl 4-Pyridylketone

SCHEMBL28979293

CC(=O)c1ccncc1.CO

nearest known ligand 0.56

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NAPRT Q6XQN6 1/20 0.56
TP53 P04637 1/20 0.54
ALDH1A1 P00352 4/20 0.52
KDM4E B2RXH2 2/20 0.50
GAA P10253 2/20 0.50
KMT2A Q03164 2/20 0.50
MAPT P10636 2/20 0.50
MEN1 O00255 1/20 0.50
CYP2C19 P33261 3/20 0.48
CYP3A4 P08684 3/20 0.48
CYP1A2 P05177 2/20 0.48
CYP2D6 P10635 2/20 0.48
MPO P05164 1/20 0.48
ADORA3 P0DMS8 1/20 0.48
CYP2A6 P11509 1/20 0.48
CYP2C9 P11712 2/20 0.47
POLB P06746 1/20 0.47
SMN1; SMN2 Q16637 1/20 0.47
BAZ2B Q9UIF8 1/20 0.47
LMNA P02545 2/20 0.46

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
Methyl 4-Pyridylketone SCHEMBL55235 0.97
Methyl 4-Pyridylketone SCHEMBL27911491 0.95 NAPRT (0.56) NAPRTTP53ALDH1A1KDM4EGAA
Methyl 4-Pyridylketone SCHEMBL28197397 0.92 NAPRT (0.54) NAPRTTP53ALDH1A1KDM4EGAA
Methyl 4-Pyridylketone SCHEMBL28826915 0.92 NAPRT (0.54) NAPRTTP53ALDH1A1KDM4EGAA
Methyl 4-Pyridylketone SCHEMBL27924145 0.92 NAPRT (0.54) NAPRTTP53ALDH1A1KDM4EGAA
Methyl 4-Pyridylketone SCHEMBL28448685 0.91 NAPRT (0.54) NAPRTTP53ALDH1A1KDM4EGAA
Methyl 4-Pyridylketone SCHEMBL27868126 0.88 NAPRT (0.50) NAPRTTP53ALDH1A1KDM4EGAA
Methyl 4-Pyridylketone SCHEMBL28197395 0.88 NAPRT (0.50) NAPRTTP53ALDH1A1KDM4EGAA
Methyl 4-Pyridylketone SCHEMBL28197393 0.88 NAPRT (0.50) NAPRTTP53ALDH1A1KDM4EGAA
Methyl 4-Pyridylketone SCHEMBL27943810 0.86 NAPRT (0.48) NAPRTTP53ALDH1A1KDM4EGAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-115869923-B Oxygen absorbing material, preparation method thereof and prepared adsorption material capable of simultaneously adsorbing oxygen and organic solvent 威格科技(苏州)股份有限公司 2024-03-22 CN claimed
CN-115869923-A Oxygen absorbing material, preparation method thereof and prepared adsorbing material capable of adsorbing oxygen and organic solvent simultaneously 威格科技(苏州)股份有限公司 2023-03-31 CN claimed
CN-115869923-B Oxygen absorbing material, preparation method thereof and prepared adsorption material capable of simultaneously adsorbing oxygen and organic solvent 威格科技(苏州)股份有限公司 2024-03-22 CN disclosed
CN-115869910-A Normal-temperature granulation method for gas adsorption material particles and application thereof 威格科技(苏州)股份有限公司 2023-03-31 CN disclosed
CN-115869923-A Oxygen absorbing material, preparation method thereof and prepared adsorbing material capable of adsorbing oxygen and organic solvent simultaneously 威格科技(苏州)股份有限公司 2023-03-31 CN disclosed