SCHEMBL5599281

SCHEMBL5599281

O=C1CCCC(=O)N1CCCN1CCc2ccccc2C1

nearest known ligand 0.83

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
HTR7 P34969 7/20 0.69
HTR1A P08908 4/20 0.66
DRD3 P35462 2/20 0.66

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
SCHEMBL5599556 0.90 HTR7 (0.73) HTR7HTR1ADRD3
Hydrochloric Acid SCHEMBL5599424 0.88 DRD3 (0.74) HTR7HTR1ADRD3
SCHEMBL7983795 0.82 HTR7 (0.94) HTR7HTR1ADRD3
SCHEMBL20364976 0.81 DRD3 (0.97) HTR7HTR1ADRD3
Hydrochloric Acid SCHEMBL20358433 0.80 DRD3 (1.00) HTR7HTR1ADRD3
SCHEMBL7983132 0.79 HTR7 (1.00) HTR7HTR1ADRD3
SCHEMBL5330830 0.78 HTR7 (0.64) HTR7HTR1ADRD3
SCHEMBL1828054 0.74 HTR1A (0.61) HTR7HTR1ADRD3
SCHEMBL155413 0.74 ALDH1A1 (0.64) HTR7HTR1ADRD3
SCHEMBL13487703 0.74 HTR7 (0.63) HTR7HTR1ADRD3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2007029078-A2 SUCCINIMIDE AND GLUTARIMIDE DERIVATIVES AS ADRENERGIC RECEPTOR ANTAGONISTS RANBAXY LABORATORIES LIMITED (IN) 2007-03-15 WO claimed
WO-2007029078-A2 SUCCINIMIDE AND GLUTARIMIDE DERIVATIVES AS ADRENERGIC RECEPTOR ANTAGONISTS RANBAXY LABORATORIES LIMITED (IN) 2007-03-15 WO disclosed