SCHEMBL7536803

SCHEMBL7536803

Cc1cccc(N2CCN([C@H]3Cc4cccc(N)c4C[C@@H]3O)CC2)c1C

nearest known ligand 0.58

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
SLC18A3 Q16572 7/20 0.58
ALDH1A1 P00352 1/20 0.43

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
SCHEMBL7536809 1.00 SLC18A3 (0.58) SLC18A3ALDH1A1
SCHEMBL7536806 1.00 SLC18A3 (0.58) SLC18A3ALDH1A1
SCHEMBL7539958 0.96 SLC18A3 (0.57) SLC18A3ALDH1A1
SCHEMBL7539953 0.96 SLC18A3 (0.57) SLC18A3ALDH1A1
SCHEMBL7540971 0.92 SLC18A3 (0.62) SLC18A3
SCHEMBL7540917 0.92 SLC18A3 (0.62) SLC18A3
SCHEMBL7537088 0.88 SLC18A3 (0.60) SLC18A3
SCHEMBL7537094 0.88 SLC18A3 (0.60) SLC18A3
SCHEMBL7541021 0.88 SLC18A3 (0.61) SLC18A3
SCHEMBL7541013 0.88 SLC18A3 (0.61) SLC18A3

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