SCHEMBL9903672

SCHEMBL9903672

CN1CCN(c2ccc3ncc(S(=O)(=O)c4cccc(Cl)c4)cc3c2)CC1

nearest known ligand 0.62

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
HTR6 P50406 16/20 0.62
HTR7 P34969 5/20 0.53
HTR2A P28223 2/20 0.50
HTR3A P46098 1/20 0.47
HTR2B P41595 2/20 0.46
DRD2 P14416 1/20 0.46
HTR2C P28335 1/20 0.46
LMNA P02545 1/20 0.45
GAA P10253 1/20 0.45
HRH4 Q9H3N8 1/20 0.45

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
SCHEMBL9903510 0.88 HTR6 (0.60) HTR6HTR7HTR3AHTR2BDRD2
SCHEMBL9903167 0.88 HTR6 (0.58) HTR6HTR7HTR2AHTR3AHTR2B
SCHEMBL9902745 0.87 HTR6 (0.66) HTR6HTR7HTR2AHTR3AHTR2B
SCHEMBL9903357 0.82 HTR6 (0.59) HTR6HTR7HTR2AHTR3AHTR2B
SCHEMBL9903819 0.82 HTR6 (0.45) HTR6HTR7HTR2AHTR2BDRD2
SCHEMBL9903853 0.81 HTR6 (0.60) HTR6HTR7HTR2AHTR3AHTR2B
SCHEMBL9901916 0.80 HTR3A (0.51) HTR6HTR7HTR2AHTR3AHTR2B
SCHEMBL5068818 0.80 HTR6 (0.77) HTR6HTR7HTR2AHTR2BDRD2
SCHEMBL9903412 0.79 HTR6 (0.60) HTR6HTR7HTR2AHTR3AHTR2B
SCHEMBL9902699 0.77 HTR3A (0.48) HTR6HTR7HTR3AHTR2BDRD2

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-1956004-B1 Quinoline derivatives and their use as 5-HT6 ligands GLAXO GROUP LTD (GB) 2012-06-13 EP claimed