SCHEMBL8831368

SCHEMBL8831368

Fc1ccc2c3ccccc3n(CCCCN3CCN(c4nsc5ccccc45)CC3)c2c1

nearest known ligand 0.61

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
HTR2A P28223 6/20 0.60
HTR7 P34969 6/20 0.60
HTR1A P08908 5/20 0.60
DRD2 P14416 4/20 0.60
HTR6 P50406 4/20 0.60
ADRA1D P25100 2/20 0.58
ADRA1B P35368 2/20 0.58

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
SCHEMBL8831391 0.94 HTR7 (0.62) HTR2AHTR7HTR1ADRD2HTR6
SCHEMBL8831311 0.90 HTR2A (0.70) HTR2AHTR7HTR1ADRD2HTR6
SCHEMBL8831833 0.88 HTR2A (0.67) HTR2AHTR7HTR1ADRD2HTR6
SCHEMBL8831356 0.88 HTR2A (0.60) HTR2AHTR7HTR1ADRD2HTR6
SCHEMBL8831337 0.84 HTR2A (0.60) HTR2AHTR7HTR1ADRD2HTR6
SCHEMBL8831371 0.82 HTR2A (0.68) HTR2AHTR7HTR1ADRD2HTR6
SCHEMBL8831323 0.81 HTR2A (0.59) HTR2AHTR7HTR1ADRD2HTR6
SCHEMBL8831867 0.80 HTR2A (0.60) HTR2AHTR7HTR1ADRD2HTR6
SCHEMBL15748307 0.77 DRD2 (0.53) HTR2AHTR7HTR1ADRD2HTR6
SCHEMBL15748164 0.77 HTR2A (0.78) HTR2AHTR7HTR1ADRD2HTR6

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0635506-A1 COMPOUND WITH ANTIPSYCHOTIC EFFECT MEIJI SEIKA KABUSHIKI KAISHA (JP) 1995-01-25 EP claimed
US-5599815-A SIDE EFFECT REDUCTION MEIJI SEIKA KABUSHIKI KAISHA (JP) 1997-02-04 US disclosed
EP-0635506-A1 COMPOUND WITH ANTIPSYCHOTIC EFFECT MEIJI SEIKA KABUSHIKI KAISHA (JP) 1995-01-25 EP disclosed