SCHEMBL7334377

SCHEMBL7334377

CN(C1CCc2c(N)cccc2C1)C(C)(C)C

nearest known ligand 0.47

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
DRD2 P14416 2/20 0.47
DRD4 P21917 1/20 0.47
DRD3 P35462 1/20 0.47
HTR1A P08908 18/20 0.46
HTR7 P34969 17/20 0.46

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
SCHEMBL7336161 0.84 DRD2 (0.63) DRD2DRD4DRD3HTR1AHTR7
Hydrochloric Acid SCHEMBL4210760 0.83 DRD2 (0.61) DRD2DRD4DRD3HTR1AHTR7
Hydrochloric Acid SCHEMBL7334834 0.83 DRD2 (0.61) DRD2DRD4DRD3HTR1AHTR7
SCHEMBL7328551 0.82 DRD2 (0.47) DRD2DRD4DRD3HTR1AHTR7
SCHEMBL7326279 0.81 DRD2 (0.48) DRD2DRD4DRD3HTR1AHTR7
SCHEMBL7328268 0.79 DRD2 (0.50) DRD2DRD4DRD3HTR1AHTR7
SCHEMBL7333690 0.78 DRD2 (0.66) DRD2DRD4DRD3HTR1AHTR7
Hydrochloric Acid SCHEMBL7337717 0.77 DRD2 (0.64) DRD2DRD4DRD3HTR1AHTR7
Hydrochloric Acid SCHEMBL9593243 0.76 DRD2 (0.53) DRD2DRD4DRD3HTR1AHTR7
SCHEMBL7335078 0.76 DRD2 (0.44) DRD2DRD4DRD3HTR1AHTR7

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