SCHEMBL1778148

SCHEMBL1778148

CC(NS(=O)(=O)c1cc2c(N3CCN(C)CC3)nccc2s1)c1cccc2ccccc12

nearest known ligand 0.48

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
HRH4 Q9H3N8 2/20 0.48
HTR6 P50406 8/20 0.41
HTR2A P28223 6/20 0.38
HTR7 P34969 5/20 0.38
HTR1A P08908 2/20 0.38
HTR2C P28335 1/20 0.38
DRD3 P35462 1/20 0.38
DRD2 P14416 5/20 0.38
KIT P10721 1/20 0.38
SORD Q00796 1/20 0.37
GUSB P08236 1/20 0.37
ABCB1 P08183 1/20 0.37
ABCC1 P33527 1/20 0.37
ABCG2 Q9UNQ0 1/20 0.37
IDH1 O75874 1/20 0.36

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 SCHEMBL1774382 0.99 HRH4 (0.47) HRH4HTR6HTR2AHTR7HTR1A
SCHEMBL1776031 0.81 KIT (0.38) HRH4HTR6HTR2ADRD3DRD2
Hydrochloric Acid SCHEMBL1775763 0.80 KIT (0.37) HRH4HTR6HTR2ADRD3DRD2
SCHEMBL1775401 0.78 HRH4 (0.45) HRH4HTR6HTR2AHTR7HTR1A
Hydrochloric Acid SCHEMBL1774702 0.77 HRH4 (0.44) HRH4HTR6HTR2AHTR7HTR1A
SCHEMBL1774608 0.74 HTR6 (0.51) HTR6HTR2AHTR7HTR1AHTR2C
SCHEMBL5015937 0.74 HRH4 (0.46) HRH4HTR2AHTR1AHTR2CDRD3
Hydrochloric Acid SCHEMBL1775137 0.73 HTR6 (0.50) HTR6HTR2AHTR7HTR1AHTR2C
SCHEMBL1775441 0.73 HTR6 (0.45) HRH4HTR6HTR2AHTR7HTR1A
SCHEMBL1775535 0.73 FLT3 (0.46) HRH4HTR6HTR2AHTR7HTR1A

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