SCHEMBL7329678

SCHEMBL7329678

CN(c1cccnc1)C1CCc2c(N)cccc2C1

nearest known ligand 0.42

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
HTR1A P08908 14/20 0.42
HTR7 P34969 14/20 0.42
GBA1 P04062 3/20 0.41
SLC18A3 Q16572 1/20 0.41
DRD2 P14416 1/20 0.40
DRD4 P21917 1/20 0.40
DRD3 P35462 1/20 0.40

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
SCHEMBL7329067 0.86 DRD2 (0.43) HTR1AHTR7DRD2DRD4DRD3
SCHEMBL7324986 0.80 KDM4E (0.55) HTR1AHTR7SLC18A3DRD2DRD4
SCHEMBL7335055 0.79 GRIN2B (0.48) DRD2DRD4DRD3
SCHEMBL7333382 0.78 CHRNA7 (0.45) DRD2DRD4DRD3
SCHEMBL7336161 0.77 DRD2 (0.63) HTR1AHTR7DRD2DRD4DRD3
SCHEMBL7328283 0.77 HTR1A (0.43) HTR1AHTR7DRD2DRD4DRD3
SCHEMBL7330680 0.77 HTR1A (0.43) HTR1AHTR7DRD2DRD4DRD3
SCHEMBL7329385 0.77 HTR1A (0.43) HTR1AHTR7DRD2DRD4DRD3
SCHEMBL7334435 0.76 DRD2 (0.47) HTR1AHTR7DRD2DRD4DRD3
SCHEMBL7329980 0.76 GRIN2B (0.49) 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