SCHEMBL22905119

SCHEMBL22905119

CCCCCc1cc2c(c3c1C(=O)OC1(CCCC1)O3)-c1cc(C)ccc1C(C)(C)O2

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CNR2 P34972 15/20 0.52
▸ CNR1 P21554 12/20 0.52
▸ TRPA1 O75762 2/20 0.52
▸ TRPV1 Q8NER1 2/20 0.52
▸ TRPV3 Q8NET8 2/20 0.52
▸ TRPV4 Q9HBA0 2/20 0.52
▸ TRPV2 Q9Y5S1 2/20 0.52
▸ CYP1A1 P04798 1/20 0.52
▸ CYP1A2 P05177 1/20 0.52
▸ CYP2A6 P11509 1/20 0.52
▸ CYP2B6 P20813 1/20 0.52
▸ SLC6A2 P23975 1/20 0.52
▸ HTR2A P28223 1/20 0.52
▸ SLC6A4 P31645 1/20 0.52
▸ OPRM1 P35372 1/20 0.52
▸ CYP2J2 P51589 1/20 0.52
▸ CYP1B1 Q16678 1/20 0.52
▸ PPARG P37231 1/20 0.45
▸ TDP1 Q9NUW8 1/20 0.41
▸ L3MBTL1 Q9Y468 1/20 0.41

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
SCHEMBL29886843 1.00 CNR2 (0.52) CNR2CNR1TRPA1TRPV1TRPV3
SCHEMBL29886803 0.89 CNR2 (0.57) CNR2CNR1TRPA1TRPV1TRPV3
SCHEMBL29669920 0.85 CNR2 (0.56) CNR2CNR1TRPA1TRPV1TRPV3
SCHEMBL22905130 0.84 CNR2 (0.56) CNR2CNR1TRPA1TRPV1TRPV3
SCHEMBL22904988 0.83 CNR2 (0.52) CNR2CNR1TRPA1TRPV1TRPV3
SCHEMBL29669879 0.83 CNR2 (0.52) CNR2CNR1TRPA1TRPV1TRPV3
SCHEMBL22905115 0.83 CNR2 (0.52) CNR2CNR1TRPA1TRPV1TRPV3
SCHEMBL22905114 0.82 CNR2 (0.53) CNR2CNR1TRPA1TRPV1TRPV3
SCHEMBL22905118 0.82 CNR2 (0.51) CNR2CNR1TRPA1TRPV1TRPV3
SCHEMBL22905133 0.82 CNR2 (0.53) CNR2CNR1TRPA1TRPV1TRPV3

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-2021007660-A1 CANNABINOID DERIVATIVES CANOPY GROWTH CORPORATION (CA) 2021-01-21 — — WO disclosed
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