SCHEMBL1775934

SCHEMBL1775934

CCc1cccc(NS(=O)(=O)c2cc3c(N4CCNCC4)nccc3s2)c1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTR6 P50406 10/20 0.44
HTR1D P28221 3/20 0.44
HTR1B P28222 3/20 0.44
HTR2C P28335 3/20 0.44
HTR1A P08908 4/20 0.42
USP2 O75604 1/20 0.42
LMNA P02545 1/20 0.42
CYP1A2 P05177 1/20 0.42
CYP3A4 P08684 1/20 0.42
MAPK1 P28482 1/20 0.42
CLK4 Q9HAZ1 1/20 0.42
GUSB P08236 2/20 0.41
HTR7 P34969 3/20 0.41
HTR2B P41595 1/20 0.41
DRD2 P14416 2/20 0.40
MEN1 O00255 1/20 0.40
MAPT P10636 1/20 0.40
PKM P14618 1/20 0.40
KMT2A Q03164 1/20 0.40
NTRK1 P04629 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 SCHEMBL1774686 0.99 HTR6 (0.44) HTR6HTR1DHTR1BHTR2CHTR1A
SCHEMBL1776023 0.87 HTR2C (0.43) HTR6HTR1DHTR1BHTR2CHTR1A
SCHEMBL1777202 0.86 HTR6 (0.48) HTR6HTR1DHTR1BHTR2CHTR1A
Hydrochloric Acid SCHEMBL1776078 0.86 HTR2C (0.42) HTR6HTR1DHTR1BHTR2CHTR1A
Hydrochloric Acid SCHEMBL1775919 0.86 HTR6 (0.47) HTR6HTR1DHTR1BHTR2CHTR1A
SCHEMBL1777693 0.84 IDH2 (0.44) HTR6HTR1DHTR1BHTR2CHTR1A
Hydrochloric Acid SCHEMBL1776483 0.83 IDH2 (0.43) HTR6HTR1DHTR1BHTR2CHTR1A
SCHEMBL1775888 0.83 HTR6 (0.46) HTR6HTR1DHTR1BHTR2CHTR1A
Hydrochloric Acid SCHEMBL1775502 0.82 HTR6 (0.45) HTR6HTR1DHTR1BHTR2CHTR1A
SCHEMBL1775636 0.81 HTR6 (0.47) HTR6HTR1DHTR1BHTR2CHTR1A

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