SCHEMBL7539028

SCHEMBL7539028

Oc1ccccc1N1CCN([C@H]2Cc3c(I)cccc3C[C@@H]2O)CC1

nearest known ligand 0.61

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
SLC18A3 Q16572 9/20 0.55
GAA P10253 2/20 0.40
ALDH1A1 P00352 1/20 0.40
HTT P42858 1/20 0.40
HTR7 P34969 1/20 0.39

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
SCHEMBL7539036 1.00 SLC18A3 (0.55) SLC18A3GAAALDH1A1HTTHTR7
SCHEMBL7536554 0.86 SLC18A3 (0.56) SLC18A3
SCHEMBL7537073 0.86 SLC18A3 (0.57) SLC18A3ALDH1A1
SCHEMBL7536552 0.86 SLC18A3 (0.56) SLC18A3
SCHEMBL7537080 0.86 SLC18A3 (0.57) SLC18A3ALDH1A1
SCHEMBL7536549 0.86 SLC18A3 (0.56) SLC18A3
SCHEMBL7537075 0.86 SLC18A3 (0.57) SLC18A3ALDH1A1
SCHEMBL7537731 0.85 SLC18A3 (0.60) SLC18A3HTR7
SCHEMBL7537729 0.85 SLC18A3 (0.60) SLC18A3HTR7
SCHEMBL7537726 0.85 SLC18A3 (0.60) SLC18A3HTR7

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-1205473-A1 VESAMICOL PIPERAZINE DERIVATIVES AND DRUGS CONTAINING THE SAME DAIICHI RADIOISOTOPE LABORATORIES, LTD. (JP) 2002-05-15 EP disclosed