SCHEMBL7330353

SCHEMBL7330353

CN(CCCc1ccsc1)C1CCc2c(N)cccc2C1

nearest known ligand 0.53

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
DRD2 P14416 3/20 0.53
DRD3 P35462 2/20 0.53
DRD4 P21917 1/20 0.53
GRIN2B Q13224 5/20 0.43
GRIN1 Q05586 2/20 0.40
DRD1 P21728 1/20 0.39
HTR1A P08908 2/20 0.38
HTR7 P34969 2/20 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
SCHEMBL7333909 0.97 DRD2 (0.52) DRD2DRD3DRD4GRIN2BGRIN1
SCHEMBL7329375 0.96 DRD2 (0.52) DRD2DRD3DRD4GRIN2BGRIN1
SCHEMBL7334552 0.94 DRD2 (0.58) DRD2DRD3DRD4GRIN2BDRD1
SCHEMBL7328620 0.88 DRD2 (0.59) DRD2DRD3DRD4GRIN2BDRD1
SCHEMBL7326249 0.87 DRD2 (0.49) DRD2DRD3DRD4GRIN2BDRD1
SCHEMBL7327607 0.85 GRIN2B (0.54) DRD2DRD3DRD4GRIN2BGRIN1
SCHEMBL7328894 0.85 DRD2 (0.58) DRD2DRD3DRD4GRIN2BDRD1
SCHEMBL7333090 0.84 DRD2 (0.57) DRD2DRD3DRD4GRIN2BDRD1
SCHEMBL7328153 0.83 DRD2 (0.67) DRD2DRD3DRD4DRD1HTR1A
SCHEMBL7326705 0.83 GRIN2B (0.48) DRD2DRD3DRD4GRIN2BGRIN1

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