SCHEMBL1776012

SCHEMBL1776012

CN1CCN(c2nccc3sc(S(=O)(=O)NCCc4cccs4)cc23)CC1

nearest known ligand 0.43

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
GUSB P08236 1/20 0.43
HTR2A P28223 14/20 0.42
DRD2 P14416 13/20 0.42
HTR7 P34969 12/20 0.42
HTR6 P50406 11/20 0.42
HRH4 Q9H3N8 2/20 0.41
DRD3 P35462 2/20 0.38

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
Hydrochloric Acid SCHEMBL1775921 0.99 GUSB (0.42) GUSBHTR2ADRD2HTR7HTR6
SCHEMBL1774492 0.90 GUSB (0.54) GUSBHTR2ADRD2HTR7HTR6
Hydrochloric Acid SCHEMBL1775163 0.89 GUSB (0.53) GUSBHTR2ADRD2HTR7HTR6
SCHEMBL1774424 0.86 GBA1 (0.42) GUSB
SCHEMBL1774595 0.81 TSHR (0.43)
Hydrochloric Acid SCHEMBL1776278 0.80 TSHR (0.42)
SCHEMBL1775535 0.78 FLT3 (0.46) GUSBHTR2ADRD2HTR7HTR6
SCHEMBL1775401 0.77 HRH4 (0.45) HTR2ADRD2HTR7HTR6HRH4
Hydrochloric Acid SCHEMBL1773881 0.77 FLT3 (0.45) GUSBHTR2ADRD2HTR7HTR6
Hydrochloric Acid SCHEMBL1774702 0.77 HRH4 (0.44) HTR2ADRD2HTR7HTR6HRH4

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-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 claimed