SCHEMBL7290976

SCHEMBL7290976

Clc1cc2[nH]cc(CCCCN3CCCC(c4ccccc4)C3)c2cc1Cl

nearest known ligand 0.58

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ DRD2 P14416 2/20 0.46
▸ DRD3 P35462 2/20 0.46
▸ DRD1 P21728 1/20 0.46
▸ DRD4 P21917 1/20 0.46
▸ DRD5 P21918 1/20 0.46
▸ HTR7 P34969 1/20 0.44
▸ MPO P05164 1/20 0.43
▸ HTR1A P08908 1/20 0.43

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
SCHEMBL7288031 0.89 HTR1A (0.54) DRD2DRD3DRD4HTR7MPO
SCHEMBL7288569 0.88 DRD2 (0.49) DRD2DRD3DRD1DRD4DRD5
SCHEMBL7279846 0.86 HTR1A (0.60) DRD2DRD3DRD4HTR7HTR1A
SCHEMBL7281958 0.86 HTR1A (0.46) DRD2DRD3DRD1DRD4DRD5
SCHEMBL7282326 0.85 HTR1A (0.47) DRD2DRD3DRD1DRD4DRD5
SCHEMBL7282164 0.85 HTR1A (0.58) DRD2DRD3DRD4HTR7HTR1A
SCHEMBL7289420 0.85 MPO (0.64) DRD2HTR7MPOHTR1A
SCHEMBL7280976 0.85 DRD2 (0.50) DRD2DRD3DRD4HTR1A
SCHEMBL7282130 0.85 CYP1A2 (0.60) DRD2DRD3DRD4HTR7HTR1A
SCHEMBL7281848 0.83 HTR1A (0.64) DRD2DRD3DRD1DRD4DRD5

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
EP-0114603-A1 Indole derivatives MERCK PATENT GmbH (DE) 1984-08-01 — — EP disclosed
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