SCHEMBL8961655

SCHEMBL8961655

CCCC[Sn](CCCC)(CCCC)c1cc(OC)c(OCC)c(C(=O)NCC2CCCN2CC)c1

nearest known ligand 0.61

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
DRD3 P35462 1/20 0.60
ABCG2 Q9UNQ0 1/20 0.59
DRD2 P14416 3/20 0.54

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
SCHEMBL8961614 0.94 DRD3 (0.68) DRD3ABCG2DRD2
SCHEMBL8961613 0.85 DRD2 (0.68) DRD3DRD2
SCHEMBL27678961 0.85 DRD2 (0.70) DRD3ABCG2DRD2
SCHEMBL9253650 0.80 DRD2 (0.58) DRD3DRD2
SCHEMBL10355545 0.78 DRD2 (0.72) DRD3ABCG2DRD2
SCHEMBL10355543 0.78 DRD2 (0.72) DRD3ABCG2DRD2
SCHEMBL16234612 0.78 ABCG2 (0.80) DRD3ABCG2DRD2
SCHEMBL9423109 0.76 DRD2 (0.53) ABCG2DRD2
SCHEMBL10355427 0.76 DRD2 (0.80) DRD3ABCG2DRD2
SCHEMBL10355426 0.76 DRD2 (0.80) DRD3ABCG2DRD2

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-5480631-A Radioiodinated benzamines and method of their use as radioimaging VANDERBILT UNIVERSITY (US) 1996-01-02 US disclosed