SCHEMBL11601281

SCHEMBL11601281

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

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CNR1 P21554 13/20 0.48
▸ CNR2 P34972 12/20 0.47
▸ DRD3 P35462 1/20 0.41
▸ NR1I2 O75469 1/20 0.41
▸ ADORA3 P0DMS8 1/20 0.41
▸ SLC6A3 Q01959 1/20 0.41
▸ TSHR P16473 2/20 0.41
▸ ALDH1A1 P00352 1/20 0.41
▸ TP53 P04637 1/20 0.41
▸ CYP1A2 P05177 1/20 0.41
▸ CYP3A4 P08684 1/20 0.41
▸ ALOX15 P16050 1/20 0.41
▸ NFKB1 P19838 1/20 0.41
▸ MAPK1 P28482 1/20 0.41
▸ THPO P40225 1/20 0.41
▸ HSD17B10 Q99714 1/20 0.41
▸ TDP1 Q9NUW8 1/20 0.41
▸ MEN1 O00255 1/20 0.41
▸ NPC1 O15118 1/20 0.41
▸ GMNN O75496 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
SCHEMBL11600469 0.91 CNR1 (0.50) CNR1CNR2DRD3NR1I2ADORA3
SCHEMBL11602228 0.91 CNR1 (0.47) CNR1CNR2DRD3NR1I2ADORA3
SCHEMBL11599815 0.88 CNR1 (0.49) CNR1CNR2DRD3NR1I2ADORA3
SCHEMBL11601087 0.86 CNR1 (0.45) CNR1CNR2DRD3NR1I2ADORA3
SCHEMBL11599680 0.85 CNR1 (0.47) CNR1CNR2NR1I2ADORA3SLC6A3
SCHEMBL11602050 0.85 CNR1 (0.47) CNR1CNR2NR1I2ADORA3SLC6A3
SCHEMBL11600434 0.84 CNR1 (0.49) CNR1CNR2DRD3NR1I2ADORA3
SCHEMBL11603524 0.83 CNR2 (0.46) CNR1CNR2NR1I2ADORA3SLC6A3
SCHEMBL11602544 0.82 CNR2 (0.57) CNR1CNR2NR1I2ADORA3SLC6A3
SCHEMBL11601858 0.81 CNR1 (0.46) CNR1CNR2DRD3NR1I2ADORA3

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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