SCHEMBL3237118

SCHEMBL3237118

[CH2]CCCN1CCN(c2cccc(Cl)c2Cl)CC1

nearest known ligand 0.74

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
DRD2 P14416 18/20 0.74
DRD3 P35462 14/20 0.74
DRD4 P21917 4/20 0.62
HTR2A P28223 4/20 0.60
SLC6A2 P23975 1/20 0.60
SLC6A4 P31645 1/20 0.60
HTR1A P08908 3/20 0.57
HTR7 P34969 3/20 0.57
HTR6 P50406 3/20 0.57
OPRM1 P35372 1/20 0.56
ADRA1A P35348 1/20 0.56

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
SCHEMBL2088368 0.89 KDM4E (0.68) DRD2DRD3DRD4HTR1AADRA1A
SCHEMBL14494878 0.86 DRD2 (0.76) DRD2DRD3DRD4HTR2ASLC6A2
SCHEMBL29785752 0.86 DRD2 (0.76) DRD2DRD3DRD4HTR2ASLC6A2
SCHEMBL1193607 0.85 DRD2 (0.83) DRD2DRD3DRD4HTR2ASLC6A2
SCHEMBL31322363 0.85 DRD2 (0.74) DRD2DRD3DRD4HTR2ASLC6A2
SCHEMBL12441074 0.85 DRD2 (1.00) DRD2DRD3DRD4HTR2ASLC6A2
SCHEMBL14494808 0.85 DRD2 (0.74) DRD2DRD3DRD4HTR2ASLC6A2
SCHEMBL2216581 0.85 DRD2 (0.74) DRD2DRD3DRD4HTR2ASLC6A2
SCHEMBL2096264 0.84 DRD2 (0.67) DRD2DRD3DRD4OPRM1
Hydrochloric Acid SCHEMBL5366724 0.84 DRD2 (0.81) DRD2DRD3DRD4HTR2ASLC6A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1836192-A2 ARYL PIPERAZINE DERIVATIVES FOR THE TREATMENT OF NEUROPSYCHIATRIC DISORDERS Universita' Degli Studi di Siena (IT) 2007-09-26 EP claimed
WO-2006072608-A2 ARYL PIPERAZINE DERIVATIVES FOR THE TREATMENT OF NEUROPSYCHIATRIC DISORDERS UNIVERSITÁ DEGLI STUDI DI SIENA (IT) 2006-07-13 WO claimed
CN-103833643-A Benzimidazolyl piperazine compound and preparation method and pharmaceutical composition thereof LIAONING BEILEI BIOLOG PHARMACEUTICAL CO LTD 2014-06-04 CN disclosed
CN-103833642-A Use of benzo five-membered azaheterocyclyl piperazine derivatives LIAONING BEILEI BIOLOG PHARMACEUTICAL CO LTD 2014-06-04 CN disclosed
WO-2010025235-A1 SELECTIVE LIGANDS FOR THE DOPAMINE 3 (D3) RECEPTOR AND METHODS OF USING THE SAME REGENTS OF THE UNIVERSITY OF MICHIGAN (US) 2010-03-04 WO disclosed
EP-1836192-A2 ARYL PIPERAZINE DERIVATIVES FOR THE TREATMENT OF NEUROPSYCHIATRIC DISORDERS Universita' Degli Studi di Siena (IT) 2007-09-26 EP disclosed
WO-2006072608-A2 ARYL PIPERAZINE DERIVATIVES FOR THE TREATMENT OF NEUROPSYCHIATRIC DISORDERS UNIVERSITÁ DEGLI STUDI DI SIENA (IT) 2006-07-13 WO disclosed