SCHEMBL30964290

SCHEMBL30964290

Oc1ccc(CNCCN2CCN(c3cccc(Cl)c3Cl)CC2)cc1O

nearest known ligand 0.55

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ DRD3 P35462 16/20 0.55
▸ DRD2 P14416 15/20 0.55
▸ DRD4 P21917 6/20 0.49
▸ ADRA1A P35348 1/20 0.47
▸ FAAH O00519 1/20 0.46

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
SCHEMBL14270569 0.77 DRD2 (0.72) DRD3DRD2DRD4ADRA1A
SCHEMBL30964289 0.74 DRD2 (0.55) DRD3DRD2
SCHEMBL1193545 0.72 DRD2 (1.00) DRD3DRD2DRD4
SCHEMBL14270571 0.72 DRD2 (0.66) DRD3DRD2DRD4
SCHEMBL14494936 0.71 DRD2 (0.74) DRD3DRD2DRD4
SCHEMBL30964239 0.70 DRD2 (0.56) DRD3DRD2
SCHEMBL1193607 0.70 DRD2 (0.83) DRD3DRD2DRD4ADRA1A
SCHEMBL1896873 0.70 DRD2 (0.72) DRD3DRD2DRD4
SCHEMBL2782258 0.70 DRD2 (1.00) DRD3DRD2DRD4
SCHEMBL12164841 0.70 DRD2 (0.72) DRD3DRD2DRD4ADRA1A

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
CN-118121699-A TPK agonists and methods of using the same for treating neurodegenerative diseases 上海日馨医药科技股份有限公司 2024-06-04 — — CN disclosed
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