SCHEMBL24933641

SCHEMBL24933641

NC(=O)c1cc(-c2ccc(OCc3cccnc3Cl)cc2)c(C(F)(F)F)[nH]c1=O

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAOB P27338 2/20 0.39
ALOX5AP P20292 1/20 0.38
PRKAB2 O43741 2/20 0.36
PRKAG1 P54619 2/20 0.36
PRKAA2 P54646 2/20 0.36
PRKAA1 Q13131 2/20 0.36
PRKAG3 Q9UGI9 2/20 0.36
PRKAG2 Q9UGJ0 2/20 0.36
PRKAB1 Q9Y478 2/20 0.36
FFAR1 O14842 2/20 0.36
FFAR4 Q5NUL3 2/20 0.36
PDE10A Q9Y233 1/20 0.36
SCN2A Q99250 1/20 0.35
SCN10A Q9Y5Y9 1/20 0.35
CYP2C19 P33261 1/20 0.35
GYS1 P13807 2/20 0.35
HSD17B1 P14061 3/20 0.35
HSD17B2 P37059 3/20 0.35
PARP10 Q53GL7 3/20 0.34
PARP15 Q460N3 2/20 0.34

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
SCHEMBL30240668 1.00 MAOB (0.39) MAOBALOX5APPRKAB2PRKAG1PRKAA2
SCHEMBL24933521 0.90 MAOB (0.40) MAOBALOX5APFFAR1FFAR4PDE10A
SCHEMBL30240735 0.90 MAOB (0.40) MAOBALOX5APFFAR1FFAR4PDE10A
SCHEMBL24933639 0.89 NMT1 (0.40) MAOBFFAR1FFAR4GYS1HSD17B1
SCHEMBL24933799 0.87 PARP10 (0.39) MAOBFFAR1FFAR4GYS1HSD17B1
SCHEMBL30240673 0.87 PARP10 (0.39) MAOBFFAR1FFAR4GYS1HSD17B1
SCHEMBL24933222 0.86 PRKAB2 (0.44) MAOBPRKAB2PRKAG1PRKAA2PRKAA1
SCHEMBL24933644 0.84 SYK (0.38) MAOBPDE10AHSD17B1HSD17B2PARP10
SCHEMBL24933620 0.84 PARP10 (0.51) PDE10APARP10
SCHEMBL30240779 0.84 PARP10 (0.51) PDE10APARP10

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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
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