SCHEMBL11270511

SCHEMBL11270511

CCCN1CCCCC(c2cccc(OC)c2)C1

nearest known ligand 0.93

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
DRD2 P14416 10/20 0.93
DRD3 P35462 9/20 0.67
DRD4 P21917 7/20 0.64
DRD1 P21728 5/20 0.64
DRD5 P21918 5/20 0.64
SIGMAR1 Q99720 3/20 0.63
NFKB1 P19838 1/20 0.63
PRCP P42785 1/20 0.63
EBP Q15125 1/20 0.63
ACHE P22303 1/20 0.61

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
SCHEMBL2861859 0.96 DRD2 (1.00) DRD2DRD3DRD4DRD1DRD5
SCHEMBL2861863 0.96 DRD2 (1.00) DRD2DRD3DRD4DRD1DRD5
Bromide SCHEMBL7314081 0.95 DRD2 (0.97) DRD2DRD3DRD4DRD1DRD5
Hydrochloric Acid SCHEMBL7317357 0.95 DRD2 (0.97) DRD2DRD3DRD4DRD1DRD5
Ammonia Solution, Strong SCHEMBL7206823 0.95 DRD2 (0.97) DRD2DRD3DRD4DRD1DRD5
SCHEMBL7314494 0.91 DRD2 (0.87) DRD2DRD3DRD4DRD1DRD5
SCHEMBL7353948 0.89 DRD2 (0.86) DRD2DRD3DRD4DRD1DRD5
Hydrochloric Acid SCHEMBL7316558 0.88 DRD2 (0.84) DRD2DRD3DRD4DRD1DRD5
SCHEMBL7315588 0.88 DRD2 (0.84) DRD2DRD3DRD4DRD1DRD5
Preclamol SCHEMBL10510876 0.87 DRD2 (0.83) DRD2DRD3DRD4DRD1DRD5

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
EP-0062019-A1 New phenyl-perhydroazepines Aktiebolaget Hässle (SE) 1982-10-06 EP disclosed