SCHEMBL7328341

SCHEMBL7328341

CN(CCCCc1ccoc1)C1CCc2c(N)cccc2C1

nearest known ligand 0.44

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
GRIN2B Q13224 2/20 0.41
GRIN1 Q05586 1/20 0.41
DRD2 P14416 7/20 0.40
DRD3 P35462 6/20 0.40
DRD1 P21728 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
SCHEMBL7328585 0.99 DRD2 (0.41) GRIN2BGRIN1DRD2DRD3DRD1
SCHEMBL7329471 0.97 GRIN2B (0.40) GRIN2BGRIN1DRD2DRD3DRD1
SCHEMBL7325663 0.93 DRD2 (0.42) DRD2DRD3DRD1
SCHEMBL7330395 0.88 DRD2 (0.47) DRD2DRD3DRD1
SCHEMBL7328110 0.87 DRD2 (0.48) DRD2DRD3DRD1
SCHEMBL7329005 0.86 GRIN2B (0.55) GRIN2BGRIN1DRD2DRD3DRD1
SCHEMBL7332957 0.86 HTR1A (0.40) DRD2DRD3DRD1
SCHEMBL7327800 0.85 GRIN2B (0.54) GRIN2BGRIN1DRD2DRD3DRD1
SCHEMBL7329557 0.84 DRD2 (0.47) DRD2DRD3DRD1
SCHEMBL7328536 0.83 GRIN2B (0.49) GRIN2BGRIN1DRD2DRD3DRD1

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