SCHEMBL7931969

SCHEMBL7931969

CCCN(CCCCCCNCCc1ccc(S(C)(=O)=O)cc1)C1CCc2c(ccc(O)c2CO)C1

nearest known ligand 0.53

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
DRD3 P35462 6/20 0.53
ADRA1D P25100 5/20 0.50
ADRA1A P35348 5/20 0.50
ADRA1B P35368 5/20 0.50
DRD2 P14416 5/20 0.49

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
SCHEMBL7801343 1.00 DRD3 (0.53) DRD3ADRA1DADRA1AADRA1BDRD2
SCHEMBL7799044 0.91 ADRA1D (0.60) DRD3ADRA1DADRA1AADRA1BDRD2
SCHEMBL7368019 0.91 DRD3 (0.55) DRD3ADRA1DADRA1AADRA1BDRD2
SCHEMBL7799046 0.91 ADRA1D (0.60) DRD3ADRA1DADRA1AADRA1BDRD2
Bromide SCHEMBL7799003 0.90 ADRA1D (0.59) DRD3ADRA1DADRA1AADRA1BDRD2
Bromide SCHEMBL7333859 0.90 ADRA1D (0.59) DRD3ADRA1DADRA1AADRA1BDRD2
Bromide SCHEMBL7333855 0.90 ADRA1D (0.59) DRD3ADRA1DADRA1AADRA1BDRD2
SCHEMBL7367026 0.89 DRD3 (0.53) DRD3ADRA1DADRA1AADRA1BDRD2
SCHEMBL7341916 0.88 ADRA1D (0.58) DRD3ADRA1DADRA1AADRA1BDRD2
SCHEMBL7341913 0.88 ADRA1D (0.58) DRD3ADRA1DADRA1AADRA1BDRD2

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6232348-B1 AGONISTS OF THE DOPAMINERGIC RECEPTORS MORE POTENT THAN DOPAMINE AND OTHER KNOWN COMPOUNDS, DEPRIVED OF INTERACTION WITH OTHER RECEPTORS AND ORALLY BIOAVAILABLE WITH A LONG TERM OF ACTION ZAMBON GROUP S.P.A. (IT) 2001-05-15 US disclosed
EP-0966423-A1 HYDROXYMETHYL DERIVATIVES OF 2-AMINO-1,2,3,4-TETRAHYDRONAPHTHALENE AS CARDIOVASCULAR AGENT ZAMBON GROUP S.p.A. (IT) 1999-12-29 EP disclosed
WO-1998038154-A1 HYDROXYMETHYL DERIVATIVES OF 2-AMINO-1,2,3,4-TETRAHYDRONAPHTHALENE AS CARDIOVASCULAR AGENT ZAMBON GROUP S.P.A. (IT) 1998-09-03 WO disclosed