SCHEMBL11275967

SCHEMBL11275967

FC(F)(F)c1ccccc1N1CCN(CCCOc2ccc3c(c2)CCC3)CC1

nearest known ligand 0.65

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
DRD2 P14416 10/20 0.65
HRH3 Q9Y5N1 4/20 0.54
HRH1 P35367 2/20 0.54
HTR2A P28223 6/20 0.52
HTR1A P08908 5/20 0.52
KCNH2 Q12809 3/20 0.52
ALDH1A1 P00352 1/20 0.51
LMNA P02545 1/20 0.51
TP53 P04637 1/20 0.51
GAA P10253 1/20 0.51
MAPT P10636 1/20 0.51
MAPK1 P28482 1/20 0.51
HTT P42858 1/20 0.51
SMN1; SMN2 Q16637 1/20 0.51
SLC6A2 P23975 1/20 0.48
SLC6A4 P31645 1/20 0.48
FAAH O00519 1/20 0.48
DRD3 P35462 1/20 0.48

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
SCHEMBL11265017 0.97 DRD2 (0.69) DRD2HRH3HRH1HTR2AHTR1A
SCHEMBL11275993 0.86 LMNA (0.67) DRD2HRH3HRH1HTR2AHTR1A
SCHEMBL11267243 0.84 DRD2 (0.62) DRD2HRH3HRH1HTR2AHTR1A
SCHEMBL11269670 0.83 HTR2A (0.55) DRD2HTR2AHTR1ASLC6A4FAAH
SCHEMBL11275908 0.83 DRD2 (0.67) DRD2HRH3HRH1HTR2AHTR1A
SCHEMBL11274506 0.82 SLC6A2 (0.72) DRD2ALDH1A1LMNAMAPTSMN1; SMN2
SCHEMBL11266439 0.81 DRD2 (0.67) DRD2HRH3HRH1HTR2AHTR1A
SCHEMBL11219235 0.81 HRH1 (0.80) DRD2HRH3HRH1HTR2AHTR1A
SCHEMBL11268707 0.81 SLC6A4 (0.65) DRD2HRH3HRH1KCNH2SMN1; SMN2
SCHEMBL11262793 0.80 RECQL (0.66) DRD2HRH3HRH1HTR2ASMN1; SMN2

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
US-4339580-A TRANQUILIZERS, SEDATIVES MITSUBISHI CHEMICAL INDUSTRIES, LIMITED (JP) 1982-07-13 US disclosed
EP-0021368-B1 PIPERAZINYLALKOXYINDANES AND ACID ADDITION SALTS THEREOF MITSUBISHI KASEI CORPORATION (JP) 1982-05-19 EP disclosed