SCHEMBL8557609

SCHEMBL8557609

CCC(N1CCCC1)N(C)S(=O)(=O)c1ccc(Br)cc1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ SIGMAR1 Q99720 5/20 0.51
▸ MEN1 O00255 3/20 0.40
▸ KMT2A Q03164 3/20 0.40
▸ L3MBTL1 Q9Y468 1/20 0.40
▸ SLC6A2 P23975 1/20 0.40
▸ SLC6A4 P31645 1/20 0.40
▸ SLC6A3 Q01959 1/20 0.40
▸ AGER Q15109 1/20 0.39
▸ POLB P06746 1/20 0.37
▸ PKM P14618 1/20 0.37
▸ PSEN1 P49768 1/20 0.37
▸ PSEN2 P49810 1/20 0.37
▸ APH1B Q8WW43 1/20 0.37
▸ NCSTN Q92542 1/20 0.37
▸ APH1A Q96BI3 1/20 0.37
▸ PSENEN Q9NZ42 1/20 0.37
▸ HPGD P15428 1/20 0.36
▸ MAPT P10636 1/20 0.36
▸ MITF O75030 1/20 0.36
▸ RAB9A P51151 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
SCHEMBL8552302 0.88 MAPT (0.48) SIGMAR1L3MBTL1POLBMAPT
Hydrochloric Acid SCHEMBL8555665 0.87 MAPT (0.47) SIGMAR1L3MBTL1POLBMAPT
SCHEMBL8553855 0.76 HTR2A (0.48) MEN1KMT2ASLC6A2SLC6A4SLC6A3
SCHEMBL8622342 0.74 SLC6A2 (0.44) SIGMAR1MEN1KMT2ASLC6A2SLC6A4
SCHEMBL16125046 0.71 AGER (0.48) SIGMAR1AGERHPGDMAPTSMN1; SMN2
SCHEMBL8595290 0.69 HTT (0.48) MEN1KMT2AL3MBTL1SLC6A2SLC6A4
SCHEMBL4271065 0.69 SIGMAR1 (0.97) SIGMAR1PSEN1PSEN2APH1BNCSTN
SCHEMBL3012193 0.67 SIGMAR1 (0.54) SIGMAR1MAPTRAB9ASMN1; SMN2
SCHEMBL4273445 0.67 SIGMAR1 (0.69) SIGMAR1PSEN1PSEN2APH1BNCSTN
SCHEMBL8595603 0.67 SIGMAR1 (0.82) SIGMAR1L3MBTL1SLC6A4PSEN1PSEN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0883613-A1 SULFONAMIDE DERIVATIVES AS 5HT7 RECEPTOR ANTAGONISTS SMITHKLINE BEECHAM PLC (GB) 1998-12-16 — — EP claimed
WO-1997029097-A1 SULFONAMIDE DERIVATIVES AS 5HT7 RECEPTOR ANTAGONISTS SMITHKLINE BEECHAM PLC (GB) 1997-08-14 — — WO claimed
EP-0883613-A1 SULFONAMIDE DERIVATIVES AS 5HT7 RECEPTOR ANTAGONISTS SMITHKLINE BEECHAM PLC (GB) 1998-12-16 — — EP disclosed
WO-1997029097-A1 SULFONAMIDE DERIVATIVES AS 5HT7 RECEPTOR ANTAGONISTS SMITHKLINE BEECHAM PLC (GB) 1997-08-14 — — WO disclosed
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