SCHEMBL7280006

SCHEMBL7280006

Fc1ccc(C2CCCN(CCCCc3c[nH]c4ccccc34)C2)cc1

nearest known ligand 0.79

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ HTR1A P08908 7/20 0.57
▸ HTR2A P28223 4/20 0.53
▸ DRD2 P14416 4/20 0.53
▸ HTR7 P34969 3/20 0.53
▸ SLC6A4 P31645 1/20 0.53
▸ HRH1 P35367 1/20 0.53
▸ DRD3 P35462 1/20 0.53
▸ MPO P05164 1/20 0.52
▸ HTR6 P50406 2/20 0.51

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
SCHEMBL7279846 0.91 HTR1A (0.60) HTR1AHTR2ADRD2HTR7SLC6A4
SCHEMBL7282164 0.90 HTR1A (0.58) HTR1AHTR2ADRD2HTR7SLC6A4
SCHEMBL7288835 0.90 HTR1A (0.55) HTR1AHTR2ADRD2HTR7SLC6A4
SCHEMBL7278140 0.90 HTR1A (0.55) HTR1AHTR2ADRD2HTR7SLC6A4
SCHEMBL7289056 0.90 HTR1A (0.57) HTR1AHTR2ADRD2HTR7SLC6A4
SCHEMBL7281710 0.90 HTR1A (0.55) HTR1AHTR2ADRD2HTR7SLC6A4
SCHEMBL7292092 0.89 HTR1A (0.57) HTR1AHTR2ADRD2HTR7SLC6A4
SCHEMBL11224823 0.88 HTR1A (0.64) HTR1AHTR2ADRD2HTR7SLC6A4
SCHEMBL7281848 0.88 HTR1A (0.64) HTR1AHTR2ADRD2HTR7SLC6A4
SCHEMBL7289420 0.88 MPO (0.64) HTR1AHTR2ADRD2HTR7SLC6A4

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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