SCHEMBL6646604

SCHEMBL6646604

[CH2]S(=O)(=O)CCc1ccc(Cl)cc1

nearest known ligand 0.46

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
TAAR1 Q96RJ0 2/20 0.46
MEN1 O00255 2/20 0.45
KMT2A Q03164 2/20 0.45
PTGES2 Q9H7Z7 6/20 0.44
AOC3 Q16853 1/20 0.44
CA12 O43570 1/20 0.41
CA1 P00915 1/20 0.41
CA2 P00918 1/20 0.41
CA4 P22748 1/20 0.41
CA9 Q16790 1/20 0.41
CNR2 P34972 1/20 0.41
MAOB P27338 1/20 0.41
RECQL P46063 1/20 0.39
ALDH1A1 P00352 1/20 0.39
CYP3A4 P08684 1/20 0.39
MAPK1 P28482 1/20 0.39
IDO1 P14902 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
SCHEMBL198598 0.82 TAAR1 (0.50) TAAR1MEN1KMT2APTGES2AOC3
SCHEMBL27804764 0.80 TAAR1 (0.48) TAAR1MEN1KMT2APTGES2AOC3
SCHEMBL105528 0.80 TAAR1 (0.48) TAAR1MEN1KMT2APTGES2AOC3
SCHEMBL8113789 0.78 RECQL (0.64) TAAR1MEN1KMT2APTGES2AOC3
SCHEMBL29001383 0.78 MGLL (0.47) TAAR1MEN1KMT2APTGES2AOC3
SCHEMBL3135932 0.78 TAAR1 (0.46) TAAR1MEN1KMT2APTGES2CA12
SCHEMBL515211 0.77 CA2 (0.53) PTGES2CA12CA1CA2CA9
SCHEMBL2375914 0.77 KMT2A (0.48) TAAR1MEN1KMT2APTGES2CA12
SCHEMBL4704220 0.77 TAAR1 (0.45) TAAR1MEN1KMT2APTGES2CA12
SCHEMBL4704224 0.77 TAAR1 (0.45) TAAR1MEN1KMT2APTGES2CA12

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1487801-A1 7-ARYLSULFONAMIDO-2,3,4,5-TETRAHYDRO-1H-BENZO[D]AZEPINE DERIVATIVES WITH 5-HT6 RECEPTOR AFFINITY FOR THE TREATMENT OF CNS DISORDERS GLAXO GROUP LIMITED (GB) 2004-12-22 EP claimed
WO-2003068751-A1 7-ARYLSULFONAMIDO-2,3,4,5-TETRAHYDRO-1H-BENZO'DIAZEPINE DERIVATIVES WITH 5-HT6 RECEPTOR AFFINITY FOR THE REATMENT OF CNS DISORDERS GLAXO GROUP LIMITED (GB) 2003-08-21 WO claimed