SCHEMBL11599815

SCHEMBL11599815

CCCCCCC(C)(C)c1cc(O)c(C2=C(CBr)CCC(C)C2)c(O)c1

nearest known ligand 0.49

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ CNR1 P21554 13/20 0.49
▸ CNR2 P34972 13/20 0.48
▸ NR1I2 O75469 1/20 0.42
▸ ADORA3 P0DMS8 1/20 0.42
▸ SLC6A3 Q01959 1/20 0.42
▸ DRD3 P35462 1/20 0.40

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
SCHEMBL11602228 0.92 CNR1 (0.47) CNR1CNR2NR1I2ADORA3SLC6A3
SCHEMBL11600469 0.90 CNR1 (0.50) CNR1CNR2NR1I2ADORA3SLC6A3
SCHEMBL11601281 0.88 CNR1 (0.48) CNR1CNR2NR1I2ADORA3SLC6A3
SCHEMBL11599680 0.86 CNR1 (0.47) CNR1CNR2NR1I2ADORA3SLC6A3
SCHEMBL11602050 0.86 CNR1 (0.47) CNR1CNR2NR1I2ADORA3SLC6A3
SCHEMBL11601087 0.85 CNR1 (0.45) CNR1CNR2NR1I2ADORA3SLC6A3
SCHEMBL11603524 0.84 CNR2 (0.46) CNR1CNR2NR1I2ADORA3SLC6A3
SCHEMBL11600434 0.83 CNR1 (0.49) CNR1CNR2NR1I2ADORA3SLC6A3
SCHEMBL11601858 0.79 CNR1 (0.46) CNR1CNR2NR1I2ADORA3SLC6A3
SCHEMBL11602882 0.79 CNR2 (0.46) CNR1CNR2

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-4092344-A Cyclohexenyl resorcinol derivatives ELI LILLY AND COMPANY (US) 1978-05-30 — — US disclosed
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