SCHEMBL24933607

SCHEMBL24933607

NC(=O)c1cc(-c2ccc(OCc3cnccc3C3CC3)cc2)c(C(F)(F)F)[nH]c1=O

nearest known ligand 0.39

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
HSD17B2 P37059 8/20 0.39
HSD17B1 P14061 8/20 0.39
SCN9A Q15858 1/20 0.36
KDM4C Q9H3R0 1/20 0.35
FFAR4 Q5NUL3 3/20 0.34
CYP11B2 P19099 2/20 0.34
CAMKK2 Q96RR4 2/20 0.33
CDK5 Q00535 1/20 0.33
CDK5R1 Q15078 1/20 0.33
GSK3B P49841 1/20 0.33
CYP11B1 P15538 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
SCHEMBL30240763 0.86 HSD17B1 (0.37) HSD17B2HSD17B1SCN9AFFAR4CAMKK2
SCHEMBL24933610 0.86 HSD17B1 (0.37) HSD17B2HSD17B1SCN9AFFAR4CAMKK2
SCHEMBL30240751 0.86 HSD17B1 (0.41) HSD17B2HSD17B1SCN9ACDK5CDK5R1
SCHEMBL24933735 0.86 HSD17B1 (0.41) HSD17B2HSD17B1SCN9ACDK5CDK5R1
SCHEMBL24933386 0.85 CDC7 (0.38) HSD17B2HSD17B1CYP11B2CDK5CDK5R1
SCHEMBL30240731 0.84 PARP10 (0.41) HSD17B2HSD17B1CDK5CDK5R1
SCHEMBL24933028 0.84 PARP10 (0.41) HSD17B2HSD17B1CDK5CDK5R1
SCHEMBL30240778 0.84 MKNK1 (0.43) HSD17B2HSD17B1CYP11B2CDK5CDK5R1
SCHEMBL24933882 0.84 MKNK1 (0.43) HSD17B2HSD17B1CYP11B2CDK5CDK5R1
SCHEMBL24933810 0.83 FFAR4 (0.40) HSD17B2HSD17B1FFAR4

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