SCHEMBL6189296

SCHEMBL6189296

COc1ccc(S(=O)(=O)N2CCc3c(ccc(Cl)c3Cl)C2)cc1N1CCN(C)CC1

nearest known ligand 0.64

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
HTR6 P50406 14/20 0.64
L3MBTL1 Q9Y468 1/20 0.57
LMNA P02545 2/20 0.51
USP2 O75604 1/20 0.51
GLA P06280 1/20 0.51
TSHR P16473 1/20 0.51
MAPK1 P28482 1/20 0.51
HSD17B10 Q99714 1/20 0.51
SMN1; SMN2 Q16637 2/20 0.49
HTT P42858 1/20 0.49
CYP3A4 P08684 1/20 0.48
CYP2C19 P33261 1/20 0.48
NPSR1 Q6W5P4 1/20 0.48

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 SCHEMBL6188988 0.99 HTR6 (0.63) HTR6L3MBTL1LMNAUSP2GLA
SCHEMBL6186037 0.92 HTR6 (0.65) HTR6L3MBTL1LMNAUSP2GLA
Hydrochloric Acid SCHEMBL6187379 0.91 HTR6 (0.64) HTR6L3MBTL1LMNAUSP2GLA
SCHEMBL6186973 0.89 HTR6 (0.80) HTR6L3MBTL1LMNAUSP2GLA
Hydrochloric Acid SCHEMBL6187971 0.88 HTR6 (0.78) HTR6L3MBTL1LMNAUSP2GLA
SCHEMBL6187107 0.86 HTR6 (0.65) HTR6L3MBTL1LMNAUSP2GLA
SCHEMBL6186315 0.84 HTR6 (0.78) HTR6L3MBTL1LMNAUSP2GLA
SCHEMBL6190503 0.84 HTR6 (0.61) HTR6L3MBTL1SMN1; SMN2CYP3A4CYP2C19
Hydrochloric Acid SCHEMBL6187759 0.83 HTR6 (0.77) HTR6L3MBTL1LMNAUSP2GLA
Hydrochloric Acid SCHEMBL6188289 0.83 HTR6 (0.60) HTR6L3MBTL1SMN1; SMN2CYP3A4CYP2C19

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0994862-B1 SULPHONAMIDE DERIVATIVES BEING 5-HT6 RECEPTOR ANTAGONISTS AND PROCESS FOR THEIR PREPARATION SMITHKLINE BEECHAM PLC (GB) 2005-06-01 EP claimed
CN-1087294-C Novel compounds SMITHKLINE BEECHAM PLC (GB) 2002-07-10 CN claimed
EP-0994862-B1 SULPHONAMIDE DERIVATIVES BEING 5-HT6 RECEPTOR ANTAGONISTS AND PROCESS FOR THEIR PREPARATION SMITHKLINE BEECHAM PLC (GB) 2005-06-01 EP disclosed
CN-1087294-C Novel compounds SMITHKLINE BEECHAM PLC (GB) 2002-07-10 CN disclosed
US-6316450-B1 PIPERAZINE COMPOUNDS FOR TREATING DEPRESSION AND ANXIETY SMITHKLINE BEECHAM P.L.C. (GB) 2001-11-13 US disclosed
EP-0994862-A2 SULPHONAMIDE DERIVATIVES BEING 5-HT6 RECEPTOR ANTAGONISTS AND PROCESS FOR THEIR PREPARATION SMITHKLINE BEECHAM PLC (GB) 2000-04-26 EP disclosed
WO-1999002502-A2 SULPHONAMIDE DERIVATIVES BEING 5-HT6 RECEPTOR ANTAGONISTS AND PROCESS FOR THEIR PREPARATION SMITHKLINE BEECHAM PLC (GB) 1999-01-21 WO disclosed