SCHEMBL7328342

SCHEMBL7328342

CN(Cc1cc2ccccc2[nH]1)C1CCc2c(N)cccc2C1

nearest known ligand 0.47

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
HTR1A P08908 6/20 0.41
HTR7 P34969 6/20 0.41
DRD2 P14416 1/20 0.39
DRD3 P35462 1/20 0.39
CHRNA7 P36544 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
SCHEMBL7327507 0.90 CHRNA7 (0.42) HTR1AHTR7DRD2DRD3CHRNA7
SCHEMBL7328262 0.88 BCHE (0.43) HTR1AHTR7DRD2DRD3CHRNA7
SCHEMBL7327744 0.88 DRD2 (0.45) HTR1AHTR7DRD2DRD3
SCHEMBL7330583 0.87 BCHE (0.41) HTR1AHTR7DRD2DRD3CHRNA7
SCHEMBL7334570 0.86 BCHE (0.40) DRD2DRD3CHRNA7
SCHEMBL7326539 0.82 DRD2 (0.44) HTR1AHTR7DRD2DRD3
SCHEMBL7328242 0.81 HTR7 (0.43) HTR1AHTR7DRD2DRD3
SCHEMBL7327193 0.80 BCHE (0.44) HTR7DRD2DRD3
SCHEMBL7331942 0.79 DRD2 (0.43) HTR7DRD2DRD3
SCHEMBL7327537 0.79 DRD2 (0.45) HTR7DRD2DRD3

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