SCHEMBL8478366

SCHEMBL8478366

COc1c(O)c(C)[c]c(-c2ccccc2)c1-c1ccccc1

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDE4B Q07343 6/20 0.61
PDE4A P27815 5/20 0.61
PDE4C Q08493 5/20 0.61
PDE4D Q08499 5/20 0.61
GAA P10253 6/20 0.38
MGAM O43451 4/20 0.38
SI P14410 4/20 0.38
MGAM2 Q2M2H8 4/20 0.38
HK2 P52789 1/20 0.37
SLCO2B1 O94956 1/20 0.36
PRSS1 P07477 1/20 0.36
PRSS2 P07478 1/20 0.36
CREB1 P16220 1/20 0.36
PRSS3 P35030 1/20 0.36
FLT3 P36888 1/20 0.36
BACE1 P56817 1/20 0.35
ALDH1A1 P00352 3/20 0.35
KDM4E B2RXH2 2/20 0.35
MAPT P10636 2/20 0.35
PTPRS Q13332 1/20 0.35

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
SCHEMBL8481016 0.89 PDE4B (0.59) PDE4BPDE4APDE4CPDE4DGAA
SCHEMBL8479895 0.87 PDE4B (0.43) PDE4BPDE4APDE4CPDE4DGAA
SCHEMBL8479443 0.86 PDE4B (0.46) PDE4BPDE4APDE4CPDE4DALDH1A1
SCHEMBL8474890 0.81 PDE4B (0.54) PDE4BPDE4APDE4CPDE4DGAA
SCHEMBL8476378 0.79 PDE4B (0.50) PDE4BPDE4APDE4CPDE4DALDH1A1
SCHEMBL8479393 0.79 PDE4B (0.51) PDE4BPDE4APDE4CPDE4DGAA
SCHEMBL8480648 0.78 PDE4B (0.44) PDE4BPDE4APDE4CPDE4DALDH1A1
SCHEMBL8482098 0.76 PDE4B (0.56) PDE4BPDE4APDE4CPDE4DGAA
SCHEMBL8479030 0.76 GAA (0.44) PDE4BPDE4APDE4CPDE4DGAA
SCHEMBL8476950 0.75 PDE4B (0.42) PDE4BPDE4APDE4CPDE4DGAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6004988-A Carboxylic acid derivatives, their preparation and their use BASF AKTIENGESELLSCHAFT (DE) 1999-12-21 US disclosed