SCHEMBL9602806

SCHEMBL9602806

Fc1ccc(C(CCCN2CCN(c3cccnc3)CC2)c2ccc(F)cc2)cc1

nearest known ligand 0.63

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DRD3 P35462 6/20 0.63
HTR2A P28223 4/20 0.63
HTR1A P08908 3/20 0.63
DRD4 P21917 2/20 0.63
HTR7 P34969 2/20 0.63
DRD2 P14416 6/20 0.62
LMNA P02545 2/20 0.52
HTT P42858 2/20 0.52
NPSR1 Q6W5P4 2/20 0.52
SIGMAR1 Q99720 6/20 0.51
CYP1A2 P05177 2/20 0.50
GAA P10253 2/20 0.50
CYP2C9 P11712 2/20 0.50
SLC6A2 P23975 2/20 0.50
SLC6A4 P31645 2/20 0.50
SLC6A3 Q01959 2/20 0.50
HRH1 P35367 2/20 0.50
KDM4E B2RXH2 1/20 0.50
MEN1 O00255 1/20 0.50
NPC1 O15118 1/20 0.50

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 SCHEMBL9603075 0.79 SLC6A2 (0.64) DRD3HTR2AHTR1ADRD4DRD2
SCHEMBL9602967 0.78 SIGMAR1 (0.79) DRD2SIGMAR1CYP1A2GAACYP2C9
Fumaric Acid SCHEMBL9601866 0.77 DRD4 (0.60) DRD3HTR2AHTR1ADRD4HTR7
Fumaric Acid SCHEMBL9601877 0.77 DRD4 (0.60) DRD3HTR2AHTR1ADRD4HTR7
SCHEMBL9601882 0.77 SIGMAR1 (0.56) DRD3HTR2AHTR1ADRD4HTR7
Hydrochloric Acid SCHEMBL9603058 0.76 DRD2 (0.79) DRD3HTR2AHTR1ADRD4HTR7
SCHEMBL5023694 0.76 DRD2 (0.65) DRD3HTR2AHTR1ADRD4DRD2
SCHEMBL9601079 0.75 HSD11B1 (0.57) DRD3HTR2AHTR1ADRD4HTR7
SCHEMBL5864076 0.75 DRD4 (0.57) DRD3HTR2AHTR1ADRD4HTR7
SCHEMBL9602079 0.74 SLC6A9 (0.55) DRD3HTR2AHTR1AHTR7DRD2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0308476-B1 BISPHENYLALKYLPIPERAZINE DERIVATIVES, A METHOD OF THEIR PREPARATION AND A PHARMACEUTICAL PREPARATION Kabi Pharmacia AB (SE) 1993-02-03 EP disclosed