SCHEMBL7544218

SCHEMBL7544218

Cc1cccc(N2CCN([C@@H]3Cc4cccc(N)c4C[C@H]3O)CC2)c1

nearest known ligand 0.57

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
SLC18A3 Q16572 7/20 0.57
DHFR P00374 1/20 0.42

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
SCHEMBL7542382 1.00 SLC18A3 (0.57) SLC18A3DHFR
SCHEMBL7542388 1.00 SLC18A3 (0.57) SLC18A3DHFR
SCHEMBL7539031 0.97 SLC18A3 (0.56) SLC18A3DHFR
SCHEMBL7539027 0.97 SLC18A3 (0.56) SLC18A3DHFR
SCHEMBL7539321 0.88 SLC18A3 (0.59) SLC18A3
SCHEMBL7539322 0.88 SLC18A3 (0.59) SLC18A3
SCHEMBL7539005 0.87 SLC18A3 (0.70) SLC18A3
SCHEMBL7540346 0.87 SLC18A3 (0.70) SLC18A3
SCHEMBL7539009 0.87 SLC18A3 (0.70) SLC18A3
SCHEMBL7539196 0.85 SLC18A3 (0.58) 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