SCHEMBL7541824

SCHEMBL7541824

Cc1ccc(C)c(N2CCN([C@H]3Cc4ccc(N)cc4C[C@@H]3O)CC2)c1

nearest known ligand 0.60

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
SLC18A3 Q16572 3/20 0.60
MAPT P10636 1/20 0.46
TSHR P16473 3/20 0.44
MEN1 O00255 2/20 0.44
KMT2A Q03164 2/20 0.44
GAA P10253 1/20 0.42
ALOX12 P18054 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
ALDH1A1 P00352 3/20 0.41
HTT P42858 2/20 0.41
POLB P06746 2/20 0.39
LMNA P02545 3/20 0.38
HSD17B10 Q99714 1/20 0.38
CA12 O43570 1/20 0.37
CA1 P00915 1/20 0.37
CA2 P00918 1/20 0.37
CA9 Q16790 1/20 0.37

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
SCHEMBL7541826 1.00 SLC18A3 (0.60) SLC18A3MAPTTSHRMEN1KMT2A
SCHEMBL7537244 1.00 SLC18A3 (0.60) SLC18A3MAPTTSHRMEN1KMT2A
SCHEMBL7537251 1.00 SLC18A3 (0.60) SLC18A3MAPTTSHRMEN1KMT2A
SCHEMBL7537232 0.86 SLC18A3 (0.60) SLC18A3MAPTTSHRMEN1KMT2A
SCHEMBL7536876 0.86 SLC18A3 (0.60) SLC18A3MAPTTSHRMEN1KMT2A
SCHEMBL7537234 0.86 SLC18A3 (0.60) SLC18A3MAPTTSHRMEN1KMT2A
SCHEMBL7537228 0.86 SLC18A3 (0.60) SLC18A3MAPTTSHRMEN1KMT2A
SCHEMBL7536879 0.86 SLC18A3 (0.60) SLC18A3MAPTTSHRMEN1KMT2A
SCHEMBL7536882 0.86 SLC18A3 (0.60) SLC18A3MAPTTSHRMEN1KMT2A
SCHEMBL7538963 0.81 SLC18A3 (0.55) SLC18A3MAPTTSHRMEN1KMT2A

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