SCHEMBL13463196

SCHEMBL13463196

CCCCCCC(C)(C)c1cc(O)c2c(c1)OC(C)(C)C[C@H]2CC(=O)CC

nearest known ligand 0.54

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ CNR2 P34972 14/20 0.54
▸ CNR1 P21554 12/20 0.54
▸ NR1I2 O75469 1/20 0.54
▸ ADORA3 P0DMS8 1/20 0.54
▸ SLC6A3 Q01959 1/20 0.54
▸ DRD3 P35462 1/20 0.52
▸ GLRA1 P23415 1/20 0.51

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
SCHEMBL10482651 0.91 CNR2 (0.55) CNR2CNR1NR1I2ADORA3SLC6A3
SCHEMBL10482654 0.89 CNR2 (0.53) CNR2CNR1NR1I2ADORA3SLC6A3
SCHEMBL10367726 0.89 CNR2 (0.53) CNR2CNR1NR1I2ADORA3SLC6A3
SCHEMBL10482622 0.87 CNR2 (0.58) CNR2CNR1NR1I2ADORA3SLC6A3
SCHEMBL10482800 0.85 CNR2 (0.56) CNR2CNR1NR1I2ADORA3SLC6A3
SCHEMBL10482673 0.85 CNR2 (0.56) CNR2CNR1DRD3GLRA1
SCHEMBL10482858 0.85 CNR2 (0.60) CNR2CNR1NR1I2ADORA3SLC6A3
SCHEMBL10482728 0.84 CNR1 (0.56) CNR2CNR1NR1I2ADORA3SLC6A3
SCHEMBL10482563 0.83 CNR2 (0.54) CNR2CNR1NR1I2ADORA3SLC6A3
SCHEMBL10365094 0.83 CNR2 (0.54) CNR2CNR1NR1I2ADORA3SLC6A3

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-2010022520-A1 IMPROVED SYNTHESIS OF HEXAHYDRODIBENZOPYRANONES DALTON CHEMICAL LABORATORIES INC. (CA) 2010-03-04 — — WO disclosed
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