SCHEMBL11270204

SCHEMBL11270204

FC(F)(F)c1ccccc1N1CCN(CCCCOc2cccc3c2CCC3)CC1

nearest known ligand 0.53

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
DRD2 P14416 10/20 0.53
HTR7 P34969 3/20 0.52
HTR1A P08908 10/20 0.50
HTR2A P28223 10/20 0.50
FAAH O00519 3/20 0.49
DRD3 P35462 3/20 0.48
HTR6 P50406 2/20 0.46
ALDH1A1 P00352 2/20 0.46
KDM4E B2RXH2 1/20 0.44
TDP1 Q9NUW8 1/20 0.44

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
SCHEMBL11262385 0.97 HTR7 (0.51) DRD2HTR7HTR1AHTR2AFAAH
SCHEMBL11272267 0.83 HTR2A (0.50) DRD2HTR7HTR1AHTR2ADRD3
SCHEMBL11262308 0.82 SLC6A2 (0.56) DRD2HTR7HTR1AHTR2ADRD3
SCHEMBL11273380 0.82 FAAH (0.56) DRD2HTR7HTR1AHTR2AFAAH
SCHEMBL11269670 0.82 HTR2A (0.55) DRD2HTR7HTR1AHTR2AFAAH
SCHEMBL11270870 0.82 HTR1A (0.59) DRD2HTR1AHTR2ADRD3
SCHEMBL11277272 0.81 HTR2A (0.67) DRD2HTR7HTR1AHTR2ADRD3
SCHEMBL11280944 0.81 HTR7 (0.60) DRD2HTR7DRD3
SCHEMBL11265017 0.80 DRD2 (0.69) DRD2HTR7HTR1AHTR2AFAAH
SCHEMBL11811329 0.80 HTR2A (0.58) DRD2HTR7HTR1AHTR2AFAAH

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