SCHEMBL7686048

SCHEMBL7686048

CC1(C)c2ccccc2S(=O)(=O)N1CCCN1CCN(c2ccc(Cl)c3ccccc23)CC1

nearest known ligand 0.42

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
HTR7 P34969 11/20 0.42
HTR1A P08908 10/20 0.42
DRD2 P14416 9/20 0.42
HTR2A P28223 9/20 0.42
HTR6 P50406 9/20 0.42
KDM4E B2RXH2 1/20 0.39
LMNA P02545 1/20 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
SCHEMBL7687016 0.79 HTR1A (0.53) HTR7HTR1ADRD2HTR2AHTR6
SCHEMBL7684659 0.79 MEN1 (0.54) HTR1ADRD2
SCHEMBL7683751 0.78 HTR1A (0.57) HTR7HTR1ADRD2HTR2AHTR6
SCHEMBL7686993 0.77 DRD2 (0.46) HTR7HTR1ADRD2HTR2AHTR6
SCHEMBL7683742 0.75 DRD2 (0.48) HTR7HTR1ADRD2HTR2AHTR6
SCHEMBL7686047 0.75 HTR1A (0.57) HTR7HTR1ADRD2KDM4E
SCHEMBL7686113 0.74 LMNA (0.51) KDM4ELMNA
SCHEMBL7686165 0.74 HTR7 (0.54) HTR7HTR1ADRD2HTR2AHTR6
SCHEMBL7681793 0.73 HTR1A (0.47) HTR7HTR1ADRD2HTR2AHTR6
SCHEMBL7686977 0.73 HTR1A (0.47) HTR7HTR1ADRD2HTR2AHTR6

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
US-6346622-B1 ENANTIOMORPHS AND ISOMERS ABBOTT LABORATORIES 2002-02-12 US disclosed