SCHEMBL8480648

SCHEMBL8480648

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

nearest known ligand 0.44

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
PDE4B Q07343 7/20 0.44
PDE4A P27815 5/20 0.44
PDE4C Q08493 5/20 0.44
PDE4D Q08499 5/20 0.44
ALDH1A1 P00352 3/20 0.34
CYP3A4 P08684 1/20 0.34
KDM4E B2RXH2 2/20 0.33
MAPK1 P28482 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
SQOR Q9Y6N5 1/20 0.33
ABCG2 Q9UNQ0 2/20 0.32
ABCB1 P08183 1/20 0.32
POLB P06746 1/20 0.32
SLC10A2 Q12908 1/20 0.32
HPGD P15428 1/20 0.31
LMNA P02545 1/20 0.31
MAPT P10636 1/20 0.31

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
SCHEMBL8476378 0.88 PDE4B (0.50) PDE4BPDE4APDE4CPDE4DALDH1A1
SCHEMBL8479512 0.86 ACHE (0.33) PDE4BPDE4APDE4CPDE4DALDH1A1
SCHEMBL8479443 0.84 PDE4B (0.46) PDE4BPDE4APDE4CPDE4DALDH1A1
SCHEMBL8475695 0.81 PDE4B (0.40) PDE4BPDE4APDE4CPDE4DALDH1A1
SCHEMBL8481016 0.80 PDE4B (0.59) PDE4BPDE4APDE4CPDE4DALDH1A1
SCHEMBL8481612 0.80 MAPT (0.35) PDE4BPDE4APDE4CPDE4DALDH1A1
SCHEMBL8475018 0.79 PDE4B (0.38) PDE4BPDE4APDE4CPDE4DALDH1A1
SCHEMBL8478366 0.78 PDE4B (0.61) PDE4BPDE4APDE4CPDE4DALDH1A1
SCHEMBL7533650 0.76 MAPT (0.35) PDE4BPDE4APDE4CPDE4DALDH1A1
SCHEMBL8479881 0.74 GAA (0.44) PDE4BPDE4APDE4CPDE4DMAPK1

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