SCHEMBL7364690

SCHEMBL7364690

CCCN(CCCCCCNCCc1ccc(S(C)(=O)=O)cc1)C1CCc2cc(O)c(O)cc2C1

nearest known ligand 0.63

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
DRD3 P35462 12/20 0.63
FYN P06241 1/20 0.54
DRD2 P14416 9/20 0.53

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
SCHEMBL7364686 1.00 DRD3 (0.63) DRD3FYNDRD2
Hydrochloric Acid SCHEMBL7799975 0.93 DRD3 (0.56) DRD3FYNDRD2
Hydrochloric Acid SCHEMBL7799971 0.93 DRD3 (0.56) DRD3FYNDRD2
SCHEMBL7799078 0.92 DRD3 (0.56) DRD3FYNDRD2
SCHEMBL7799075 0.92 DRD3 (0.56) DRD3FYNDRD2
Bromide SCHEMBL7360028 0.88 DRD2 (0.61) DRD3FYNDRD2
Bromide SCHEMBL7360022 0.88 DRD2 (0.61) DRD3FYNDRD2
SCHEMBL7799046 0.87 ADRA1D (0.60) DRD3DRD2
SCHEMBL7368019 0.87 DRD3 (0.55) DRD3DRD2
SCHEMBL7799044 0.87 ADRA1D (0.60) DRD3DRD2

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
EP-0781126-B1 DERIVATIVES OF 2-AMINO-1,2,3,4-TETRAHYDRO-NAPHTHALENE ACTIVE ON THE CARDIOVASCULAR SYSTEM ZAMBON SPA (IT) 2001-12-12 EP disclosed
EP-0781126-A2 DERIVATIVES OF 2-AMINO-1,2,3,4-TETRAHYDRO-NAPHTHALENE ACTIVE ON THE CARDIOVASCULAR SYSTEM ZAMBON GROUP S.p.A. (IT) 1997-07-02 EP disclosed
WO-1996008228-A2 DERIVATIVES OF 2-AMINO-1,2,3,4-TETRAHYDRO-NAPHTHALENE ACTIVE ON THE CARDIOVASCULAR SYSTEM ZAMBON GROUP S.P.A. (IT) 1996-03-21 WO disclosed