SCHEMBL8149406

SCHEMBL8149406

O=C1N(CCN2CCN(c3cccc4ccccc34)CC2)CCN1c1ccccc1

nearest known ligand 0.61

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
DRD2 P14416 9/20 0.61
DRD3 P35462 9/20 0.61
KCNH2 Q12809 3/20 0.51
HTR1A P08908 4/20 0.50
HTR7 P34969 2/20 0.50
HTR2A P28223 2/20 0.48
HTR2C P28335 1/20 0.48
DRD4 P21917 1/20 0.47

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
SCHEMBL8156167 0.83 DRD2 (0.55) DRD2DRD3KCNH2HTR2ADRD4
SCHEMBL8142915 0.83 DRD2 (0.57) DRD2DRD3KCNH2HTR2ADRD4
SCHEMBL8156679 0.83 DRD2 (0.55) DRD2DRD3KCNH2HTR2ADRD4
SCHEMBL8142907 0.83 DRD2 (0.55) DRD2DRD3HTR1A
SCHEMBL8148960 0.83 DRD2 (0.55) DRD2DRD3KCNH2HTR1AHTR2A
SCHEMBL13711982 0.82 DRD3 (0.60) DRD2DRD3KCNH2HTR1AHTR7
SCHEMBL8156689 0.82 DRD2 (0.53) DRD2DRD3KCNH2HTR2ADRD4
SCHEMBL8150800 0.79 HTR1A (0.57) HTR1A
SCHEMBL8305949 0.78 DRD2 (0.49) DRD2DRD3KCNH2HTR2ADRD4
SCHEMBL8155543 0.78 DRD2 (0.54) DRD2DRD3KCNH2HTR2ADRD4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0673375-B1 FUSED BENZO COMPOUNDS LUNDBECK & CO AS H (DK) 1999-02-24 EP claimed
US-6140331-A FOR TREATING ANXIETY DISORDERS, DEPRESSION, PSYCHOSIS, IMPULSE CONTROL DISORDERS, ALCOHOL ABUSE, ISCHAEMIC DISEASES, CARDIOVASCULAR DISORDERS, SIDE EFFECTS INDUCED BY CONVENTIONAL ANTIPSYCHOTIC AGENTS AND SENILE DEMENTIA H. LUNDBECK A/S (DK) 2000-10-31 US disclosed
EP-0673375-B1 FUSED BENZO COMPOUNDS LUNDBECK & CO AS H (DK) 1999-02-24 EP disclosed
EP-0673375-A1 FUSED BENZO COMPOUNDS H. LUNDBECK A/S (DK) 1995-09-27 EP disclosed
WO-1994013659-A1 FUSED BENZO COMPOUNDS H. LUNDBECK A/S (DK) 1994-06-23 WO disclosed