SCHEMBL24933399

SCHEMBL24933399

CC(C)(C)OC(=O)N1CCC(COc2ccc(-c3cc(C(N)=O)c(=O)[nH]c3C(F)(F)F)cc2)C1

nearest known ligand 0.52

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
CHEK2 O96017 5/20 0.52
GPR119 Q8TDV5 5/20 0.45
ALOX5AP P20292 2/20 0.43
FEN1 P39748 2/20 0.43
SCN9A Q15858 1/20 0.40
BRD3 Q15059 1/20 0.40
HDAC1 Q13547 1/20 0.40
SRC P12931 1/20 0.40
LIPE Q05469 1/20 0.39

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
SCHEMBL24933255 0.93 CHEK2 (0.47) CHEK2GPR119ALOX5APFEN1LIPE
SCHEMBL24933245 0.87 CHEK2 (0.41) CHEK2GPR119SCN9ALIPE
SCHEMBL24933831 0.87 P2RX3 (0.42) CHEK2LIPE
SCHEMBL29203336 0.87 CHEK2 (0.52) CHEK2HDAC1
SCHEMBL24933748 0.86 CHEK2 (0.42) CHEK2GPR119LIPE
SCHEMBL24933789 0.85 CHEK2 (0.42) CHEK2
SCHEMBL24933656 0.84 CHEK2 (0.43) CHEK2
SCHEMBL24933696 0.83 CHEK2 (0.38) CHEK2GPR119SRC
SCHEMBL24933403 0.83 CHEK2 (0.38) CHEK2GPR119SRC
SCHEMBL29203332 0.83 CHEK2 (0.38) CHEK2GPR119SRC

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4373809-A1 SUBSTITUTED PYRIDONE COMPOUNDS USEFUL TO TREAT ORTHOMYXOVIRUS INFECTIONS Novartis AG (CH) 2024-05-29 EP claimed
CN-117980292-A Substituted pyridone compounds for the treatment of orthomyxoviral infections 诺华股份有限公司 2024-05-03 CN claimed
WO-2023002443-A1 SUBSTITUTED PYRIDONE COMPOUNDS USEFUL TO TREAT ORTHOMYXOVIRUS INFECTIONS NOVARTIS AG (CH) 2023-01-26 WO claimed
EP-4373809-A1 SUBSTITUTED PYRIDONE COMPOUNDS USEFUL TO TREAT ORTHOMYXOVIRUS INFECTIONS Novartis AG (CH) 2024-05-29 EP disclosed
CN-117980292-A Substituted pyridone compounds for the treatment of orthomyxoviral infections 诺华股份有限公司 2024-05-03 CN disclosed
WO-2023002443-A1 SUBSTITUTED PYRIDONE COMPOUNDS USEFUL TO TREAT ORTHOMYXOVIRUS INFECTIONS NOVARTIS AG (CH) 2023-01-26 WO disclosed
WO-2023002443-A1 SUBSTITUTED PYRIDONE COMPOUNDS USEFUL TO TREAT ORTHOMYXOVIRUS INFECTIONS NOVARTIS AG (CH) 2023-01-26 WO disclosed