SCHEMBL24933362

SCHEMBL24933362

NC(=O)c1cc(-c2ccc(OCc3cccc(N)c3)cc2)c(C(F)(F)F)[nH]c1=O

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAOB P27338 8/20 0.47
PARP10 Q53GL7 3/20 0.42
PARP15 Q460N3 2/20 0.41
MRGPRX4 Q96LA9 2/20 0.40
NR4A2 P43354 1/20 0.40
PARP14 Q460N5 1/20 0.39
GSTP1 P09211 1/20 0.39
FFAR1 O14842 3/20 0.39
FFAR4 Q5NUL3 1/20 0.39
HDAC3 O15379 1/20 0.38
PARP1 P09874 1/20 0.38
HDAC4 P56524 1/20 0.38
HDAC1 Q13547 1/20 0.38
HDAC7 Q8WUI4 1/20 0.38
HDAC2 Q92769 1/20 0.38
HDAC10 Q969S8 1/20 0.38
HDAC11 Q96DB2 1/20 0.38
HDAC8 Q9BY41 1/20 0.38
HDAC6 Q9UBN7 1/20 0.38
HDAC9 Q9UKV0 1/20 0.38

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
SCHEMBL30240765 1.00 MAOB (0.47) MAOBPARP10PARP15MRGPRX4NR4A2
SCHEMBL30240782 0.90 MAOB (0.52) MAOBPARP10PARP15MRGPRX4NR4A2
SCHEMBL24932976 0.90 MAOB (0.52) MAOBPARP10PARP15MRGPRX4NR4A2
SCHEMBL24933615 0.90 MAOB (0.60) MAOBMRGPRX4NR4A2FFAR1FFAR4
SCHEMBL24933349 0.90 GSTP1 (0.50) MAOBPARP10GSTP1FFAR1
SCHEMBL30240807 0.89 MAOB (0.46) MAOBPARP10PARP15MRGPRX4FFAR1
SCHEMBL24933199 0.89 MAOB (0.46) MAOBPARP10PARP15MRGPRX4FFAR1
SCHEMBL24933666 0.88 KCNH2 (0.48) MAOBPARP10MRGPRX4FFAR1FFAR4
SCHEMBL24933457 0.86 MAOB (0.43) MAOBPARP10PARP15MRGPRX4NR4A2
SCHEMBL30240707 0.86 MAOB (0.49) MAOBFFAR1MAPT

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