SCHEMBL7980394

SCHEMBL7980394

C=S(=O)(c1cccc(Cl)c1)n1cc(N2CCN[C@H](C)C2)c2ncccc21

nearest known ligand 0.45

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
HTR6 P50406 17/20 0.45
HTR1A P08908 4/20 0.45
DRD2 P14416 4/20 0.45
HTR7 P34969 4/20 0.45
MET P08581 1/20 0.39
PRKCQ Q04759 2/20 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
SCHEMBL3178433 0.91 HTR6 (0.51) HTR6HTR1ADRD2HTR7MET
SCHEMBL3176282 0.91 HTR6 (0.51) HTR6HTR1ADRD2HTR7MET
SCHEMBL3169115 0.91 HTR6 (0.51) HTR6HTR1ADRD2HTR7MET
SCHEMBL3186106 0.81 HTR6 (0.49) HTR6HTR1ADRD2HTR7MET
SCHEMBL3182029 0.81 HTR6 (0.49) HTR6HTR1ADRD2HTR7MET
SCHEMBL3178753 0.81 HTR6 (0.49) HTR6HTR1ADRD2HTR7MET
SCHEMBL3174816 0.81 HTR6 (0.46) HTR6METPRKCQ
SCHEMBL3168400 0.81 HTR6 (0.46) HTR6METPRKCQ
SCHEMBL3178308 0.81 HTR6 (0.46) HTR6METPRKCQ
SCHEMBL3175968 0.80 HTR6 (0.51) HTR6HTR1ADRD2HTR7

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
WO-2010008832-A1 PYRROLO-PYRIDINE-3-YL-PIPERAZINE DERIVATIVES HAVING 5-HT6 RECEPTOR AFFINITY MEMORY PHARMACEUTICALS CORPORATION (US) 2010-01-21 WO disclosed