SCHEMBL7328451

SCHEMBL7328451

CCN(CCCc1ccccn1)C1CCc2c(N)cccc2C1

nearest known ligand 0.45

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
DRD2 P14416 8/20 0.45
DRD3 P35462 8/20 0.45
DRD4 P21917 3/20 0.45
HTR1A P08908 3/20 0.43
HTR7 P34969 3/20 0.43
DRD1 P21728 1/20 0.42
DRD5 P21918 1/20 0.42
ADRB2 P07550 1/20 0.42

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
SCHEMBL7332672 0.97 DRD2 (0.46) DRD2DRD3DRD4HTR1AHTR7
SCHEMBL7325098 0.96 DRD2 (0.47) DRD2DRD3DRD4HTR1AHTR7
SCHEMBL7335621 0.94 DRD2 (0.46) DRD2DRD3DRD4HTR1AHTR7
SCHEMBL7328297 0.88 GRIN1 (0.47) DRD2DRD3HTR1AHTR7DRD1
SCHEMBL7327686 0.87 DRD2 (0.48) DRD2DRD3DRD4HTR1AHTR7
SCHEMBL7335048 0.84 GRIN1 (0.47) DRD2DRD3
SCHEMBL7327584 0.84 DRD2 (0.55) DRD2DRD3DRD4HTR1AHTR7
SCHEMBL7327816 0.84 GRIN1 (0.47) DRD2DRD3
SCHEMBL7326822 0.83 DRD2 (0.48) DRD2DRD3DRD4DRD1
SCHEMBL7326173 0.83 CHRM2 (0.43) HTR1AHTR7

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-0402923-A2 2,5-Diaminotetralines, process for their preparation and their use as medicine BOEHRINGER INGELHEIM KG (DE) 1990-12-19 EP disclosed