SCHEMBL1775376

SCHEMBL1775376

Cc1ccc(C)c(S(=O)(=O)c2ccc3ccnc(N4CCNCC4)c3c2)c1

nearest known ligand 0.74

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
HTR6 P50406 10/20 0.74
HTR2C P28335 3/20 0.47
ALDH1A1 P00352 2/20 0.46
L3MBTL1 Q9Y468 2/20 0.39
RAB9A P51151 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
MEN1 O00255 1/20 0.38
KMT2A Q03164 1/20 0.38
HTR1A P08908 1/20 0.38
DRD2 P14416 1/20 0.38
HTR2A P28223 1/20 0.38
HTR7 P34969 1/20 0.38
NPSR1 Q6W5P4 1/20 0.37

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 SCHEMBL1775358 0.99 HTR6 (0.72) HTR6HTR2CALDH1A1L3MBTL1RAB9A
SCHEMBL1777219 0.92 HTR6 (0.74) HTR6HTR2CALDH1A1L3MBTL1MEN1
Hydrochloric Acid SCHEMBL1776090 0.91 HTR6 (0.72) HTR6HTR2CALDH1A1MEN1KMT2A
Hydrochloric Acid SCHEMBL1775698 0.86 HTR6 (0.78) HTR6HTR2CHTR1ADRD2HTR7
SCHEMBL1777317 0.83 HTR6 (0.74) HTR6HTR2CALDH1A1L3MBTL1MEN1
Hydrochloric Acid SCHEMBL1780248 0.82 HTR6 (0.72) HTR6HTR2CALDH1A1L3MBTL1MEN1
SCHEMBL3680498 0.82 HTR6 (0.66) HTR6HTR2C
SCHEMBL1780383 0.81 HTR6 (0.92) HTR6HTR2CL3MBTL1MEN1KMT2A
Hydrochloric Acid SCHEMBL1778263 0.80 HTR6 (0.90) HTR6HTR2CL3MBTL1MEN1KMT2A
SCHEMBL1776166 0.80 HTR6 (0.66) HTR6HTR2CHTR1ADRD2

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