SCHEMBL1775387

SCHEMBL1775387

CN1CCN(c2nccc3sc(Br)c(S(=O)(=O)O)c23)CC1

nearest known ligand 0.47

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
HRH4 Q9H3N8 2/20 0.39
ALDH1A1 P00352 1/20 0.37
MAPT P10636 1/20 0.36
HTT P42858 1/20 0.36
CHIA Q9BZP6 1/20 0.36
DRD2 P14416 2/20 0.35
HTR2A P28223 2/20 0.35
DRD3 P35462 2/20 0.35

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
SCHEMBL1775869 0.82 LMNA (0.39) HRH4HTR2ADRD3
Hydrochloric Acid SCHEMBL1776644 0.82 LMNA (0.39) HRH4HTR2ADRD3
SCHEMBL1775987 0.82 HTT (0.39) ALDH1A1MAPTHTTHTR2A
Hydrochloric Acid SCHEMBL1774418 0.81 HTT (0.39) ALDH1A1MAPTHTTHTR2A
SCHEMBL1776120 0.78 KIT (0.39) MAPTDRD2HTR2ADRD3
SCHEMBL1775433 0.78 HTR6 (0.40) DRD2HTR2ADRD3
Hydrochloric Acid SCHEMBL1775562 0.77 KIT (0.38) MAPTDRD2HTR2ADRD3
SCHEMBL5012492 0.77 HRH4 (0.40) HRH4CHIADRD2HTR2ADRD3
Hydrochloric Acid SCHEMBL1775559 0.77 ALDH1A1 (0.35) HRH4ALDH1A1DRD2HTR2ADRD3
SCHEMBL1776299 0.75 TDP1 (0.44) ALDH1A1HTT

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 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-101081845-A Substituted sulphone and sulphonamide compounds useful for the treatment of obesity, type II diabetes and cns disorders BIOVITRUM AB (SE) 2007-12-05 CN claimed
CN-1662521-A Novel compounds useful for the treatment of obesity, type II diabetes and CNS disorders BIOVITRUM AB (SE) 2005-08-31 CN claimed
US-7943639-B2 Such as 6-benzenesulfonyl-4-piperazin-1-yl-quinoline hydrochloride; for treatment of central nervous system and/or 5- HT6 receptor related disorders; for weight gain/loss PROXIMAGEN LIMITED (GB) 2011-05-17 US disclosed
CN-101081845-A Substituted sulphone and sulphonamide compounds useful for the treatment of obesity, type II diabetes and cns disorders BIOVITRUM AB (SE) 2007-12-05 CN disclosed
CN-1907982-A New compounds useful for the treatment of obesity,type II diabetes and CNS disorders BIOVITRUM AB (SE) 2007-02-07 CN disclosed
CN-1662521-A Novel compounds useful for the treatment of obesity, type II diabetes and CNS disorders BIOVITRUM AB (SE) 2005-08-31 CN disclosed