SCHEMBL24933207

SCHEMBL24933207

CC1(C)OB(c2ccc(C(c3cnco3)N3CCOCC3)cc2)OC1(C)C

nearest known ligand 0.35

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
ESR2 Q92731 1/20 0.35
LPL P06858 7/20 0.34
LIPG Q9Y5X9 7/20 0.34
F11 P03951 2/20 0.32
ACHE P22303 1/20 0.32
F2 P00734 1/20 0.32
F10 P00742 1/20 0.32
P2RX7 Q99572 1/20 0.32
ALDH1A1 P00352 2/20 0.32
MEN1 O00255 1/20 0.31
KMT2A Q03164 1/20 0.31
KDM4E B2RXH2 1/20 0.31
RECQL P46063 1/20 0.31
KCNA5 P22460 2/20 0.31
KCNH2 Q12809 1/20 0.31
HTT P42858 1/20 0.30

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
SCHEMBL24933205 0.77 LMNA (0.41) ACHEP2RX7ALDH1A1MEN1KMT2A
SCHEMBL3261417 0.76 LTA4H (0.42) ESR2LPLLIPGACHE
SCHEMBL3263042 0.76 LTA4H (0.42) ESR2LPLLIPGACHE
SCHEMBL3262944 0.76 LTA4H (0.42) ESR2LPLLIPGACHE
SCHEMBL3261902 0.72 ESR2 (0.41) ESR2LPLLIPGF11P2RX7
SCHEMBL3264000 0.71 KCNA5 (0.44) ESR2LPLLIPGF11F2
SCHEMBL138606 0.68 LPL (0.47) LPLLIPGALDH1A1MEN1KMT2A
SCHEMBL31212828 0.67 ALDH1A1 (0.49) ALDH1A1MEN1KMT2AKDM4ERECQL
SCHEMBL142528 0.67 ALDH1A1 (0.49) ALDH1A1MEN1KMT2AKDM4ERECQL
SCHEMBL171878 0.66 LPL (0.58) LPLLIPGF11

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 4 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 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