SCHEMBL7279332

SCHEMBL7279332

FC(F)(F)c1cccc(C2CCCN(CCCCc3c[nH]c4ccccc34)C2)c1

nearest known ligand 0.58

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ HTR1A P08908 6/20 0.49
▸ HTR2A P28223 2/20 0.48
▸ DRD2 P14416 2/20 0.48
▸ DRD3 P35462 2/20 0.48
▸ SLC6A4 P31645 1/20 0.48
▸ HTR7 P34969 1/20 0.48
▸ HRH1 P35367 1/20 0.48
▸ DRD4 P21917 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
SCHEMBL11316386 0.90 DRD2 (0.55) HTR1AHTR2ADRD2DRD3SLC6A4
SCHEMBL7292092 0.88 HTR1A (0.57) HTR1AHTR2ADRD2DRD3SLC6A4
SCHEMBL7279846 0.86 HTR1A (0.60) HTR1AHTR2ADRD2DRD3SLC6A4
SCHEMBL7290885 0.86 DRD2 (0.53) HTR1AHTR2ADRD2DRD3SLC6A4
SCHEMBL7281777 0.86 DRD4 (0.55) HTR1ADRD2DRD3DRD4
SCHEMBL7282434 0.86 DRD2 (0.56) HTR1AHTR2ADRD2DRD3SLC6A4
SCHEMBL7282164 0.85 HTR1A (0.58) HTR1AHTR2ADRD2DRD3SLC6A4
SCHEMBL7278939 0.85 HTR1A (0.47) HTR1AHTR2ADRD2DRD3SLC6A4
SCHEMBL7289134 0.83 HTR1A (0.59) HTR1ADRD2
SCHEMBL7281848 0.83 HTR1A (0.64) HTR1AHTR2ADRD2DRD3SLC6A4

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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