SCHEMBL6868438

SCHEMBL6868438

O=CCN1CCOC(I)C1

nearest known ligand 0.30

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
DRD3 P35462 1/20 0.30

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
SCHEMBL20570593 0.77 DRD3 (0.30) DRD3
SCHEMBL1233397 0.77 DRD3 (0.30) DRD3
SCHEMBL28976304 0.77 PDK1 (0.41) DRD3
SCHEMBL3665971 0.77 DRD3 (0.30) DRD3
SCHEMBL4447538 0.77 DRD3 (0.30) DRD3
SCHEMBL3844104 0.77 DRD3 (0.30) DRD3
SCHEMBL29946367 0.77 PDK1 (0.41) DRD3
SCHEMBL15820207 0.77 DRD3 (0.33) DRD3
Hydrochloric Acid SCHEMBL25293658 0.76
Hydrochloric Acid SCHEMBL318921 0.76

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1456188-A1 7-AMINO-BENZOTHIAZOLE DERIVATIVES AS ADENOSINE RECEPTOR LIGANDS F. HOFFMANN-LA ROCHE AG (CH) 2004-09-15 EP disclosed
WO-2003053946-A1 7-AMINO-BENZOTHIAZOLE DERIVATIVES AS ADENOSINE RECEPTOR LIGANDS F. HOFFMANN-LA ROCHE AG (CH) 2003-07-03 WO disclosed