SCHEMBL7027637

SCHEMBL7027637

CCCN1CCN(c2cccc3c2C[C@H](N)CC3)CC1

nearest known ligand 0.49

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
DRD2 P14416 9/20 0.49
DRD3 P35462 5/20 0.49
HTR6 P50406 2/20 0.48
DPP4 P27487 1/20 0.43
SIGMAR1 Q99720 1/20 0.42

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
SCHEMBL7027642 1.00 DRD2 (0.49) DRD2DRD3HTR6DPP4SIGMAR1
SCHEMBL7021575 0.93 DRD2 (0.51) DRD2DRD3DPP4
SCHEMBL7021581 0.93 DRD2 (0.51) DRD2DRD3DPP4
SCHEMBL7025590 0.91 KDM4E (0.51) DRD2DRD3DPP4
SCHEMBL7025581 0.91 KDM4E (0.51) DRD2DRD3DPP4
SCHEMBL7029878 0.90 KDM4E (0.53) DRD2DRD3DPP4
SCHEMBL7029875 0.90 KDM4E (0.53) DRD2DRD3DPP4
SCHEMBL6816574 0.86 DRD3 (0.47) DRD2DRD3HTR6SIGMAR1
SCHEMBL4788557 0.86 DRD3 (0.47) DRD2DRD3HTR6SIGMAR1
SCHEMBL7025288 0.86 DRD3 (0.47) DRD2DRD3HTR6SIGMAR1

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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0888319-B1 SUBSTITUTED 1,2,3,4-TETRAHYDRONAPHTHALENE DERIVATIVES ASTRAZENECA AB (SE) 2003-01-29 EP disclosed
US-6410530-B1 CENTRAL NERVOUS SYSTEM DISORDERS; PSYCHOLOGICAL DISORDERS ASTRAZENECA AB (SE) 2002-06-25 US disclosed
US-6124283-A Substituted 1,2,3,4-tetrahydronaphthalene derivatives ASTRA AKTIEBOLAG (SE) 2000-09-26 US disclosed
EP-0888319-A1 SUBSTITUTED 1,2,3,4-TETRAHYDRONAPHTHALENE DERIVATIVES Astra Aktiebolag (SE) 1999-01-07 EP disclosed
WO-1997034883-A1 SUBSTITUTED 1,2,3,4-TETRAHYDRONAPHTHALENE DERIVATIVES ASTRA AKTIEBOLAG (SE) 1997-09-25 WO disclosed