SCHEMBL1776290

SCHEMBL1776290

Cc1cc(C)c(S(=O)(=O)c2cc3c(N4CCNCC4)nccc3s2)c(C)c1

nearest known ligand 0.52

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
HTR6 P50406 10/20 0.52
HTR2C P28335 5/20 0.46
HTR1A P08908 3/20 0.38
HTR7 P34969 2/20 0.38
HTR1D P28221 2/20 0.38
HTR1B P28222 2/20 0.38
HTR2B P41595 1/20 0.38
HSP90AA1 P07900 2/20 0.37
HSP90AB1 P08238 2/20 0.37
TAAR1 Q96RJ0 1/20 0.36
DRD2 P14416 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 SCHEMBL1774443 0.99 HTR6 (0.51) HTR6HTR2CHTR1AHTR7HTR1D
SCHEMBL1774351 0.88 HTR6 (0.48) HTR6HTR2CHTR1AHTR1DHTR1B
Hydrochloric Acid SCHEMBL1775407 0.87 HTR6 (0.47) HTR6HTR2CHTR1AHTR7HTR1B
SCHEMBL1777663 0.85 HTR6 (0.48) HTR6HTR2CHTR1AHTR7HTR1D
Hydrochloric Acid SCHEMBL1775235 0.85 HTR6 (0.47) HTR6HTR2CHTR1A
SCHEMBL1775605 0.81 HTR6 (0.56) HTR6HTR2CHTR1AHTR7DRD2
SCHEMBL1776454 0.81 HTR6 (0.50) HTR6HTR2C
SCHEMBL5015941 0.81 HTR2C (0.53) HTR6HTR2CHTR1AHTR7DRD2
Hydrochloric Acid SCHEMBL1775612 0.81 HTR6 (0.55) HTR6HTR2CHTR1AHTR7DRD2
Hydrochloric Acid SCHEMBL1775284 0.80 HTR6 (0.49) 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