SCHEMBL1775002

SCHEMBL1775002

O=S(=O)(NCCCc1ccccc1)c1cc2c(N3CCNCC3)nccc2s1

nearest known ligand 0.43

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
HTR6 P50406 11/20 0.43
HTR2A P28223 7/20 0.43
HTR7 P34969 7/20 0.43
DRD2 P14416 6/20 0.43
GUSB P08236 4/20 0.42
HTR2C P28335 2/20 0.41
ALDH1A1 P00352 1/20 0.40
TPSAB1 Q15661 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
Hydrochloric Acid SCHEMBL1775274 0.99 HTR6 (0.43) HTR6HTR2AHTR7DRD2GUSB
SCHEMBL1774740 0.94 GUSB (0.45) HTR6HTR2AHTR7DRD2GUSB
Hydrochloric Acid SCHEMBL1775770 0.94 GUSB (0.45) HTR6HTR2AHTR7DRD2GUSB
SCHEMBL1776711 0.85 HTR6 (0.43) HTR6HTR2AHTR7DRD2GUSB
Hydrochloric Acid SCHEMBL1776453 0.84 HTR6 (0.43) HTR6HTR2AHTR7DRD2GUSB
SCHEMBL1774492 0.83 GUSB (0.54) HTR6HTR2AHTR7DRD2GUSB
Hydrochloric Acid SCHEMBL1775163 0.82 GUSB (0.53) HTR6HTR2AHTR7DRD2GUSB
SCHEMBL1775796 0.82 SLC2A1 (0.48) HTR6HTR2AHTR7DRD2
SCHEMBL1776724 0.81 GUSB (0.57) HTR6HTR7DRD2GUSB
SCHEMBL1776417 0.81 HTR6 (0.48) HTR6HTR2C

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