SCHEMBL8991948

SCHEMBL8991948

CCCN(CCCCCCN)[C@H]1CCc2c(ccc(OC)c2OC)C1

nearest known ligand 0.58

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
DRD2 P14416 9/20 0.58
DRD3 P35462 8/20 0.58
DRD4 P21917 1/20 0.58
HTR1A P08908 1/20 0.53
HTR1D P28221 1/20 0.53
HTR1B P28222 1/20 0.53

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
SCHEMBL7332925 1.00 DRD2 (0.58) DRD2DRD3DRD4HTR1AHTR1D
Hydrochloric Acid SCHEMBL7355128 0.99 DRD2 (0.57) DRD2DRD3DRD4HTR1AHTR1D
Hydrochloric Acid SCHEMBL7331556 0.99 DRD2 (0.57) DRD2DRD3DRD4HTR1AHTR1D
Hydrochloric Acid SCHEMBL7336177 0.99 DRD2 (0.57) DRD2DRD3DRD4HTR1AHTR1D
Hydrochloric Acid SCHEMBL7801369 0.99 DRD2 (0.57) DRD2DRD3DRD4HTR1AHTR1D
Hydrochloric Acid SCHEMBL7329632 0.87 DRD2 (0.55) DRD2DRD3DRD4HTR1A
Hydrochloric Acid SCHEMBL7330498 0.85 DRD3 (0.53) DRD2DRD3DRD4
Hydrochloric Acid SCHEMBL7330503 0.85 DRD3 (0.53) DRD2DRD3DRD4
SCHEMBL8044364 0.85 DRD2 (0.82) DRD2DRD3DRD4HTR1A
Hydrochloric Acid SCHEMBL7338118 0.84 DRD3 (0.53) DRD2DRD3DRD4

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-0719252-A1 DERIVATIVES OF 2-AMINO-1,2,3,4-TETRAHYDRONAPHTHALENE ACTIVE ON THE CARDIOVASCULAR SYSTEM ZAMBON GROUP S.p.A. (IT) 1996-07-03 EP disclosed