SCHEMBL7328242

SCHEMBL7328242

CN(c1cc2ccccc2[nH]1)C1CCc2c(N)cccc2C1

nearest known ligand 0.43

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
HTR7 P34969 15/20 0.43
HTR1A P08908 14/20 0.43
DRD2 P14416 2/20 0.39
DRD3 P35462 2/20 0.39
DRD4 P21917 1/20 0.38

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
SCHEMBL7328342 0.81 HTR1A (0.41) HTR7HTR1ADRD2DRD3
SCHEMBL7327507 0.80 CHRNA7 (0.42) HTR7HTR1ADRD2DRD3
SCHEMBL7328262 0.78 BCHE (0.43) HTR7HTR1ADRD2DRD3
SCHEMBL7327744 0.78 DRD2 (0.45) HTR7HTR1ADRD2DRD3DRD4
SCHEMBL7330583 0.77 BCHE (0.41) HTR7HTR1ADRD2DRD3
SCHEMBL7334570 0.77 BCHE (0.40) DRD2DRD3
SCHEMBL7326539 0.76 DRD2 (0.44) HTR7HTR1ADRD2DRD3DRD4
SCHEMBL7328589 0.75 HTR1A (0.43) HTR7HTR1ADRD2DRD3DRD4
SCHEMBL7327193 0.74 BCHE (0.44) HTR7DRD2DRD3DRD4
SCHEMBL7336161 0.74 DRD2 (0.63) HTR7HTR1ADRD2DRD3DRD4

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