SCHEMBL19259542

SCHEMBL19259542

COCCCOc1cc(C2CC(C)(C)CO2)ccc1OC

nearest known ligand 0.43

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
PDE4A P27815 4/20 0.39
PDE4B Q07343 2/20 0.39
PDE4C Q08493 2/20 0.39
PDE4D Q08499 2/20 0.39
PTAFR P25105 1/20 0.38
REN P00797 5/20 0.37
HIF1A Q16665 1/20 0.36
EPAS1 Q99814 1/20 0.36
ALDH1A1 P00352 2/20 0.36
ACHE P22303 1/20 0.34
MAPK3 P27361 1/20 0.34
MAPK1 P28482 1/20 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
SCHEMBL29613142 0.76 PDE4A (0.42) PDE4APDE4BPDE4CPDE4DREN
SCHEMBL19252773 0.76 PDE4A (0.42) PDE4APDE4BPDE4CPDE4DREN
SCHEMBL19259465 0.76 PDE4A (0.44) PDE4APDE4BPDE4CPDE4DREN
SCHEMBL14590599 0.74 PDE4A (0.41) PDE4APDE4BPDE4CPDE4DPTAFR
SCHEMBL19252795 0.74 PDE4A (0.36) PDE4APDE4BPDE4CPDE4DREN
SCHEMBL19272921 0.74 HIF1A (0.36) PDE4APDE4BPDE4CPDE4DPTAFR
SCHEMBL18423334 0.72 PDE4B (0.40) PDE4APDE4BPDE4CPDE4DREN
SCHEMBL29613148 0.72 PDE4B (0.40) PDE4APDE4BPDE4CPDE4DREN
SCHEMBL29613183 0.71 PDE4A (0.42) PDE4APDE4BPDE4CPDE4DREN
SCHEMBL19252770 0.71 PDE4A (0.42) PDE4APDE4BPDE4CPDE4DREN

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3416946-A1 TETRACYCLIC PYRIDONE COMPOUNDS AS ANTIVIRALS Novartis AG (CH) 2018-12-26 EP disclosed
WO-2017140821-A1 TETRACYCLIC PYRIDONE COMPOUNDS AS ANTIVIRALS NOVARTIS AG (CH) 2017-08-24 WO disclosed