SCHEMBL22860816

SCHEMBL22860816

CCCCCc1cc(O)c(C2C=C(C)CCC2)c2c1C(=O)OC(C)(COC)O2

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CNR1 P21554 13/20 0.38
▸ CNR2 P34972 11/20 0.38
▸ ABHD12 Q8N2K0 3/20 0.38
▸ ABHD6 Q9BV23 3/20 0.38
▸ FAAH O00519 2/20 0.38
▸ LDHA P00338 2/20 0.38
▸ TRPM8 Q7Z2W7 2/20 0.38
▸ GPR55 Q9Y2T6 2/20 0.38
▸ NR1I2 O75469 1/20 0.38
▸ GLRA1 P23415 1/20 0.38
▸ GPR183 P32249 1/20 0.38
▸ DRD3 P35462 1/20 0.38
▸ ENPP2 Q13822 1/20 0.38
▸ GPR18 Q14330 1/20 0.38
▸ DAGLA Q9Y4D2 2/20 0.37
▸ ACE2 Q9BYF1 1/20 0.37
▸ PPARG P37231 1/20 0.37
▸ NAAA Q02083 1/20 0.36
▸ TDP1 Q9NUW8 1/20 0.36
▸ L3MBTL1 Q9Y468 1/20 0.36

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
SCHEMBL29661373 1.00 CNR1 (0.38) CNR1CNR2ABHD12ABHD6FAAH
SCHEMBL29661454 0.88 DAGLA (0.40) CNR1CNR2ABHD12ABHD6FAAH
SCHEMBL22860817 0.88 DAGLA (0.40) CNR1CNR2ABHD12ABHD6FAAH
SCHEMBL22860842 0.88 CNR1 (0.43) CNR1CNR2ABHD12ABHD6FAAH
SCHEMBL29661414 0.88 CNR1 (0.43) CNR1CNR2ABHD12ABHD6FAAH
SCHEMBL22860818 0.87 CNR1 (0.37) CNR1CNR2ABHD12ABHD6FAAH
SCHEMBL29661416 0.84 CNR1 (0.41) CNR1CNR2ABHD12ABHD6FAAH
SCHEMBL22860965 0.84 CNR1 (0.41) CNR1CNR2ABHD12ABHD6FAAH
SCHEMBL22860856 0.84 DAGLA (0.38) CNR1CNR2ABHD12ABHD6FAAH
SCHEMBL29661422 0.84 DAGLA (0.38) CNR1CNR2ABHD12ABHD6FAAH

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
WO-2021000054-A1 CANNABINOID DERIVATIVES CANOPY GROWTH CORPORATION (CA) 2021-01-07 — — WO disclosed
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