SCHEMBL8611835

SCHEMBL8611835

OC(CNCc1ccc(Cl)cc1)CN1CCN(CCCC(c2ccc(F)cc2)c2ccc(F)cc2)CC1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DRD3 P35462 5/20 0.49
CACNA1F O60840 3/20 0.49
DRD4 P21917 3/20 0.49
DRD5 P21918 3/20 0.49
HRH2 P25021 3/20 0.49
ADRA1D P25100 3/20 0.49
HTR2A P28223 3/20 0.49
HTR7 P34969 3/20 0.49
ADRA1A P35348 3/20 0.49
HRH1 P35367 3/20 0.49
ADRA1B P35368 3/20 0.49
OPRM1 P35372 3/20 0.49
OPRK1 P41145 3/20 0.49
HTR6 P50406 3/20 0.49
CACNA1D Q01668 3/20 0.49
SLC6A3 Q01959 3/20 0.49
CACNA1S Q13698 3/20 0.49
CACNA1C Q13936 3/20 0.49
HTR1A P08908 2/20 0.49
ADORA3 P0DMS8 2/20 0.49

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
SCHEMBL7751327 0.91 SLC6A3 (0.54) DRD3CACNA1FDRD4DRD5HRH2
SCHEMBL8616693 0.90 HTR2A (0.50) DRD3CACNA1FDRD4DRD5HRH2
Hydrochloric Acid SCHEMBL7544797 0.90 SLC6A3 (0.53) DRD3CACNA1FDRD4DRD5HRH2
SCHEMBL8614302 0.89 KCNH2 (0.48) DRD3CACNA1FDRD4DRD5HRH2
SCHEMBL8611930 0.87 MAPK1 (0.55) DRD3CACNA1FDRD4DRD5HRH2
SCHEMBL9416417 0.86 SLC6A3 (0.42) DRD3CACNA1FDRD4DRD5HRH2
SCHEMBL7754861 0.85 DRD3 (0.48) DRD3CACNA1FDRD4DRD5HRH2
SCHEMBL9141442 0.82 DRD3 (0.49) DRD3CACNA1FDRD4DRD5HRH2
SCHEMBL8611936 0.80 SLC6A3 (0.58) DRD3CACNA1FDRD4DRD5HRH2
SCHEMBL8612001 0.80 SLC6A3 (0.59) DRD3CACNA1FDRD4DRD5HRH2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0549796-B1 DIPHENYLPIPERAZINE DERIVATIVE AND DRUG FOR CIRCULATORY ORGAN CONTAINING THE SAME POLA CHEM IND INC (JP) 1998-04-29 EP disclosed
US-5391552-A Has strong antagonism against calcium with less side effects POLA CHEMICAL INDUSTRIES, INC. (JP) 1995-02-21 US disclosed
EP-0612738-A1 Diphenylpiperazine derivative and drug for circulatory organ containing the same POLA CHEMICAL INDUSTRIES, INC. (JP) 1994-08-31 EP disclosed
EP-0549796-A1 DIPHENYLPIPERAZINE DERIVATIVE AND DRUG FOR CIRCULATORY ORGAN CONTAINING THE SAME POLA CHEMICAL INDUSTRIES INC (JP) 1993-07-07 EP disclosed