SCHEMBL24933831

SCHEMBL24933831

CC(C)(C)OC(=O)N1CCOC(COc2ccc(-c3cc(C(N)=O)c(=O)[nH]c3C(F)(F)F)cc2)C1

nearest known ligand 0.42

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
P2RX3 P56373 3/20 0.42
P2RX2 Q9UBL9 3/20 0.42
CHEK2 O96017 4/20 0.42
RET P07949 2/20 0.39
EPHA2 P29317 4/20 0.39
PDK1 Q15118 1/20 0.38
ERBB2 P04626 1/20 0.38
EPHB4 P54760 1/20 0.38
NR1H4 Q96RI1 1/20 0.36
LIPE Q05469 1/20 0.36
CSF1R P07333 1/20 0.36
JAK2 O60674 1/20 0.36

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
SCHEMBL24933835 0.91 PDK1 (0.40) CHEK2PDK1JAK2
SCHEMBL24933399 0.87 CHEK2 (0.52) CHEK2LIPE
SCHEMBL24933255 0.86 CHEK2 (0.47) CHEK2LIPE
SCHEMBL24933245 0.85 CHEK2 (0.41) CHEK2LIPE
SCHEMBL24933560 0.84 P2RX3 (0.41) P2RX3P2RX2
SCHEMBL24933748 0.84 CHEK2 (0.42) CHEK2LIPE
SCHEMBL24933840 0.83 PRKAB2 (0.46)
SCHEMBL24933739 0.83 IRAK4 (0.36) P2RX3P2RX2PDK1
SCHEMBL24932993 0.83 DRD4 (0.39)
SCHEMBL24933681 0.83 DRD4 (0.39)

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