SCHEMBL7328262

SCHEMBL7328262

CN(CCCc1cc2ccccc2[nH]1)C1CCc2c(N)cccc2C1

nearest known ligand 0.47

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
BCHE P06276 1/20 0.43
CHRNA7 P36544 2/20 0.40
DRD2 P14416 3/20 0.39
DRD3 P35462 3/20 0.39
HTR7 P34969 4/20 0.39
HTR1A P08908 3/20 0.39
HRH3 Q9Y5N1 2/20 0.37

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
SCHEMBL7330583 0.97 BCHE (0.41) BCHECHRNA7DRD2DRD3HTR7
SCHEMBL7334570 0.96 BCHE (0.40) BCHECHRNA7DRD2DRD3
SCHEMBL7327507 0.94 CHRNA7 (0.42) BCHECHRNA7DRD2DRD3HTR7
SCHEMBL7327193 0.89 BCHE (0.44) BCHEDRD2DRD3HTR7
SCHEMBL7328342 0.88 HTR1A (0.41) CHRNA7DRD2DRD3HTR7HTR1A
SCHEMBL7331942 0.86 DRD2 (0.43) BCHEDRD2DRD3HTR7
SCHEMBL7327537 0.85 DRD2 (0.45) BCHEDRD2DRD3HTR7
SCHEMBL7326539 0.84 DRD2 (0.44) DRD2DRD3HTR7HTR1A
SCHEMBL7327744 0.80 DRD2 (0.45) DRD2DRD3HTR7HTR1A
SCHEMBL7327607 0.80 GRIN2B (0.54) DRD2DRD3

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