SCHEMBL7755959

SCHEMBL7755959

OC(CNc1ccccc1)CN1CCN(CCC(c2ccc(F)cc2)c2ccc(F)cc2)CC1

nearest known ligand 0.50

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
SLC6A3 Q01959 5/20 0.50
SLC6A4 P31645 4/20 0.50
DRD2 P14416 1/20 0.47
DRD4 P21917 1/20 0.47
DRD3 P35462 1/20 0.47
HTR1A P08908 1/20 0.47
KDM1A O60341 1/20 0.47
KDM4E B2RXH2 1/20 0.45
HTT P42858 1/20 0.45

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
Hydrochloric Acid SCHEMBL7543310 0.99 SLC6A3 (0.49) SLC6A3SLC6A4DRD2DRD4DRD3
SCHEMBL4760958 0.93 CYP3A4 (0.51) SLC6A3SLC6A4DRD2DRD4DRD3
SCHEMBL8616378 0.93 CYP3A4 (0.51) SLC6A3SLC6A4DRD2DRD4DRD3
SCHEMBL8615736 0.93 CYP3A4 (0.51) SLC6A3SLC6A4DRD2DRD4DRD3
Hydrochloric Acid SCHEMBL8867248 0.92 MEN1 (0.52) SLC6A3SLC6A4DRD2DRD4DRD3
SCHEMBL7751410 0.92 SLC6A3 (0.47) SLC6A3SLC6A4DRD2DRD4DRD3
Hydrochloric Acid SCHEMBL7543578 0.92 MEN1 (0.52) SLC6A3SLC6A4DRD2DRD4DRD3
SCHEMBL8616275 0.91 KDM1A (0.51) SLC6A3SLC6A4KDM1A
Hydrochloric Acid SCHEMBL7543312 0.91 MEN1 (0.48) SLC6A3SLC6A4DRD2DRD4DRD3
SCHEMBL8677737 0.90 SCN5A (0.51) SLC6A3SLC6A4DRD2DRD4DRD3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0706796-B1 DOPAMINE RE-UPTAKE INHIBITORS FOR THE TREATMENT OF PARKINSON'S SYNDROME POLA CHEM IND INC (JP) 2001-02-28 EP claimed
US-5747493-A N-/DIPHENYLALKYL/-PIPERAZINYL-2-HYDROXYPROPYLAMINES POLA CHEMICAL INDUSTRIES, INC. (JP) 1998-05-05 US claimed
EP-0706796-A1 DOPAMINE REINCORPORATION INHIBITOR POLA CHEMICAL INDUSTRIES, INC. (JP) 1996-04-17 EP claimed
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-0549796-A1 DIPHENYLPIPERAZINE DERIVATIVE AND DRUG FOR CIRCULATORY ORGAN CONTAINING THE SAME POLA CHEMICAL INDUSTRIES INC (JP) 1993-07-07 EP disclosed