SCHEMBL11608910

SCHEMBL11608910

CCCC=CCc1cc(O)c2c(c1)OC(C)(C)[C@@H]1CCC(=O)C[C@@H]21

nearest known ligand 0.71

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ CNR2 P34972 9/20 0.63
▸ CNR1 P21554 9/20 0.60
▸ NR1I2 O75469 1/20 0.58
▸ ADORA3 P0DMS8 1/20 0.58
▸ SLC6A3 Q01959 1/20 0.58

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
SCHEMBL11578292 0.86 CNR2 (0.62) CNR2CNR1NR1I2ADORA3SLC6A3
SCHEMBL11474154 0.86 CNR2 (0.62) CNR2CNR1NR1I2ADORA3SLC6A3
SCHEMBL11578289 0.86 CNR2 (0.62) CNR2CNR1NR1I2ADORA3SLC6A3
SCHEMBL10068290 0.85 CNR2 (0.69) CNR2CNR1NR1I2ADORA3SLC6A3
SCHEMBL11455743 0.83 CNR2 (0.72) CNR2CNR1NR1I2ADORA3SLC6A3
SCHEMBL31545381 0.83 CNR2 (0.72) CNR2CNR1NR1I2ADORA3SLC6A3
SCHEMBL11541884 0.83 CNR2 (0.72) CNR2CNR1NR1I2ADORA3SLC6A3
SCHEMBL7755404 0.83 CNR2 (0.72) CNR2CNR1NR1I2ADORA3SLC6A3
SCHEMBL15558108 0.83 CNR2 (0.72) CNR2CNR1NR1I2ADORA3SLC6A3
SCHEMBL16922165 0.83 CNR2 (0.72) 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
US-4075230-A Preparation of optically active trans-hexahydrodibenzopyranones ELI LILLY AND COMPANY (US) 1978-02-21 — — US disclosed
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