SCHEMBL7371815

SCHEMBL7371815

O=C(NCCCN1CCN(c2ccccc2)CC1)c1ccc(Cl)cc1

nearest known ligand 0.84

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
DRD2 P14416 7/20 0.84
DRD4 P21917 4/20 0.84
SLC6A4 P31645 1/20 0.76
DRD3 P35462 6/20 0.73
ADRA1A P35348 2/20 0.71
TMEM97 Q5BJF2 1/20 0.66
SIGMAR1 Q99720 1/20 0.66
HTR1A P08908 1/20 0.65
POLB P06746 1/20 0.65

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
SCHEMBL7369877 0.91 DRD3 (0.77) DRD2DRD4DRD3HTR1APOLB
SCHEMBL10756632 0.88 TMEM97 (0.72) DRD2DRD4SLC6A4DRD3ADRA1A
SCHEMBL7154331 0.88 DRD2 (0.80) DRD2DRD4SLC6A4DRD3ADRA1A
SCHEMBL31061220 0.87 DRD3 (0.84) DRD2DRD4DRD3HTR1APOLB
SCHEMBL18507057 0.86 DRD3 (0.70) DRD2DRD4SLC6A4DRD3HTR1A
SCHEMBL7369645 0.85 KDM4E (0.70) DRD2DRD4SLC6A4DRD3POLB
SCHEMBL10724181 0.83 DRD2 (0.75) DRD2DRD4DRD3ADRA1ATMEM97
SCHEMBL2355678 0.83 DRD3 (0.72) DRD2DRD4DRD3HTR1A
SCHEMBL10720845 0.83 ALDH1A1 (0.76) DRD2DRD4DRD3HTR1APOLB
SCHEMBL10826554 0.82 DRD2 (0.76) DRD2DRD4SLC6A4DRD3TMEM97

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0714292-A4 SIGMA RECEPTOR LIGANDS AND THE USE THEREOF CAMBRIDGE NEUROSCIENCE INC (US) 1996-10-09 EP claimed
EP-0714292-A1 SIGMA RECEPTOR LIGANDS AND THE USE THEREOF CAMBRIDGE NEUROSCIENCE, INC. (US) 1996-06-05 EP claimed
WO-1995000131-A1 SIGMA RECEPTOR LIGANDS AND THE USE THEREOF CAMBRIDGE NEUROSCIENCE, INCORPORATED (US) 1995-01-05 WO claimed