SCHEMBL7355250

SCHEMBL7355250

CCOc1ccccc1N1CCN(CCCCN2C(=O)NCC2c2cccc(Cl)c2)CC1

nearest known ligand 0.52

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
HTR1A P08908 9/20 0.52
HTR7 P34969 7/20 0.52
DRD2 P14416 8/20 0.49
HTR2A P28223 4/20 0.49
HTR6 P50406 3/20 0.49
ADRA1A P35348 3/20 0.48
ADRA1D P25100 2/20 0.48
ADRA1B P35368 2/20 0.48
DRD3 P35462 1/20 0.47
MAPT P10636 1/20 0.47
MAPK1 P28482 1/20 0.47
L3MBTL1 Q9Y468 1/20 0.47

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
SCHEMBL7343246 0.91 ADRA1A (0.55) HTR1AHTR7DRD2ADRA1AADRA1D
SCHEMBL7343619 0.85 KCNH2 (0.54) HTR7DRD2
SCHEMBL7350906 0.79 KCNH2 (0.67) HTR1AMAPT
SCHEMBL7347718 0.78 KCNH2 (0.53) HTR1ADRD2HTR2AHTR6DRD3
SCHEMBL7353705 0.77 KCNH2 (0.52) HTR1AADRA1ADRD3
SCHEMBL7347383 0.76 SLC6A3 (0.43)
SCHEMBL7355246 0.75 HTR1A (0.60) HTR1AHTR7DRD2HTR2AHTR6
SCHEMBL10676614 0.72 DRD2 (0.68) HTR1AHTR7DRD2HTR2AHTR6
SCHEMBL7351805 0.72 HTR1A (0.52) HTR1AHTR7DRD2HTR2AHTR6
SCHEMBL10546259 0.70 DRD2 (0.63) HTR1AHTR7DRD2HTR2AHTR6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0536279-A1 SUBSTITUTED 1-(ALKOXYPHENYL)PIPERAZINES WITH CNS AND ANTIHYPERTENSIVE ACTIVITY THE UPJOHN COMPANY (US) 1993-04-14 EP claimed
WO-1992000282-A1 SUBSTITUTED 1-(ALKOXYPHENYL)PIPERAZINES WITH CNS AND ANTIHYPERTENSIVE ACTIVITY THE UPJOHN COMPANY (US) 1992-01-09 WO claimed