SCHEMBL24933255

SCHEMBL24933255

CC(C)(C)OC(=O)N1CC(COc2ccc(-c3cc(C(N)=O)c(=O)[nH]c3C(F)(F)F)cc2)C1

nearest known ligand 0.47

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
CHEK2 O96017 6/20 0.47
SLC5A1 P13866 1/20 0.40
SLC5A2 P31639 1/20 0.40
LIPE Q05469 1/20 0.39
GPR119 Q8TDV5 3/20 0.39
PRKAB2 O43741 1/20 0.39
PRKAG1 P54619 1/20 0.39
PRKAA2 P54646 1/20 0.39
PRKAA1 Q13131 1/20 0.39
PRKAG3 Q9UGI9 1/20 0.39
PRKAG2 Q9UGJ0 1/20 0.39
PRKAB1 Q9Y478 1/20 0.39
ALOX5AP P20292 2/20 0.38
FEN1 P39748 2/20 0.38
CHRNA7 P36544 1/20 0.37
TLR7 Q9NYK1 1/20 0.36
NEK2 P51955 1/20 0.35

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
SCHEMBL24933399 0.93 CHEK2 (0.52) CHEK2LIPEGPR119ALOX5APFEN1
SCHEMBL24933245 0.92 CHEK2 (0.41) CHEK2LIPEGPR119NEK2
SCHEMBL24933748 0.91 CHEK2 (0.42) CHEK2LIPEGPR119NEK2
SCHEMBL24933831 0.86 P2RX3 (0.42) CHEK2LIPE
SCHEMBL24933696 0.84 CHEK2 (0.38) CHEK2GPR119
SCHEMBL29203332 0.84 CHEK2 (0.38) CHEK2GPR119
SCHEMBL29203331 0.84 CHEK2 (0.38) CHEK2GPR119
SCHEMBL24933403 0.84 CHEK2 (0.38) CHEK2GPR119
SCHEMBL24933354 0.83 CHEK2 (0.36) CHEK2
SCHEMBL30240705 0.83 CHEK2 (0.36) CHEK2

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