SCHEMBL28545933

SCHEMBL28545933

CCOc1c(O)ccc(-c2ccccc2)c1-c1ccccc1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CNR1 P21554 1/20 0.45
CNR2 P34972 1/20 0.45
GPR55 Q9Y2T6 1/20 0.45
PDE4B Q07343 4/20 0.44
PDE4A P27815 3/20 0.44
PDE4C Q08493 3/20 0.44
PDE4D Q08499 3/20 0.44
GAA P10253 2/20 0.42
LMNA P02545 1/20 0.42
MAPK10 P53779 1/20 0.42
CREB1 P16220 1/20 0.40
BACE1 P56817 1/20 0.39
ALDH1A1 P00352 3/20 0.39
HPGD P15428 2/20 0.39
KDM4E B2RXH2 1/20 0.39
CYP1A2 P05177 1/20 0.39
CYP3A4 P08684 1/20 0.39
CYP2D6 P10635 1/20 0.39
CYP2C9 P11712 1/20 0.39
CYP2C19 P33261 1/20 0.39

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
SCHEMBL29721178 1.00 CNR1 (0.45) CNR1CNR2GPR55PDE4BPDE4A
SCHEMBL29274196 0.86 ALDH1A1 (0.40) CNR1CNR2GPR55PDE4BPDE4A
SCHEMBL28035916 0.80 GAA (0.42) CNR1CNR2GPR55PDE4BPDE4A
SCHEMBL10455954 0.80 ALDH1A1 (0.36) CNR1CNR2GPR55PDE4BPDE4A
SCHEMBL2494994 0.80 ALDH1A1 (0.36) CNR1CNR2GPR55PDE4BPDE4A
SCHEMBL31392539 0.79 HPGD (0.50) CNR1CNR2GPR55PDE4BPDE4A
SCHEMBL27506599 0.79 HPGD (0.50) CNR1CNR2GPR55PDE4BPDE4A
Propane SCHEMBL28700749 0.77 BACE1 (0.46) CNR1CNR2GPR55PDE4BPDE4A
SCHEMBL27496216 0.77 HPGD (0.52) CNR1CNR2GPR55PDE4BPDE4A
SCHEMBL29721081 0.76 ALDH1A1 (0.41) CNR1CNR2GPR55GAALMNA

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-112672993-B Novel AUTOTAC chimeric compounds and compositions comprising same for preventing, ameliorating or treating diseases by targeted protein degradation 奧土择破利悟株式会社 2024-03-08 CN disclosed
CN-114641282-A P62 ligand compound and ER-autophagy promoting use thereof 普罗泰克株式会社 2022-06-17 CN disclosed
CN-112672993-A Novel AUTOTAC chimeric compounds and compositions comprising the same for preventing, ameliorating or treating diseases through targeted protein degradation 普罗泰克株式会社 2021-04-16 CN disclosed