SCHEMBL29288109

SCHEMBL29288109

CC(C)(C)OC(=O)CCCCCCCCCCCCCOc1cccc2cc3ccccc3cc12

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CNR2 P34972 6/20 0.46
PPARG P37231 3/20 0.44
PPARA Q07869 2/20 0.44
KCNA3 P22001 1/20 0.42
CNR1 P21554 3/20 0.41
HDAC8 Q9BY41 1/20 0.41
HTR1B P28222 2/20 0.40
KDM4E B2RXH2 1/20 0.40
ALDH1A1 P00352 1/20 0.40
HPGD P15428 1/20 0.40
SLC6A4 P31645 1/20 0.39
HDAC1 Q13547 1/20 0.39
CYP2C9 P11712 1/20 0.39
MEN1 O00255 1/20 0.39
NR1I2 O75469 1/20 0.39
LMNA P02545 1/20 0.39
CHRM2 P08172 1/20 0.39
CYP3A4 P08684 1/20 0.39
ADRA2A P08913 1/20 0.39
MAPT P10636 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
SCHEMBL28603677 1.00 CNR2 (0.46) CNR2PPARGPPARAKCNA3CNR1
SCHEMBL28596800 1.00 CNR2 (0.46) CNR2PPARGPPARAKCNA3CNR1
SCHEMBL29288068 1.00 CNR2 (0.46) CNR2PPARGPPARAKCNA3CNR1
SCHEMBL28596832 1.00 CNR2 (0.46) CNR2PPARGPPARAKCNA3CNR1
SCHEMBL28592502 1.00 CNR2 (0.46) CNR2PPARGPPARAKCNA3CNR1
SCHEMBL28593468 1.00 CNR2 (0.46) CNR2PPARGPPARAKCNA3CNR1
SCHEMBL28596903 1.00 CNR2 (0.46) CNR2PPARGPPARAKCNA3CNR1
SCHEMBL28590699 1.00 CNR2 (0.46) CNR2PPARGPPARAKCNA3CNR1
SCHEMBL29288073 1.00 CNR2 (0.46) CNR2PPARGPPARAKCNA3CNR1
SCHEMBL28918633 1.00 CNR2 (0.46) CNR2PPARGPPARAKCNA3CNR1

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
CN-113454090-A Compound having polycyclic aromatic skeleton and endoperoxide compound thereof 川崎化成工业株式会社 2021-09-28 CN disclosed