SCHEMBL8014222

SCHEMBL8014222

CCC1(CC)CN(c2ccccc2)c2cc(OC)c(OC)cc2S(=O)(=O)C1

nearest known ligand 0.41

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
SLC10A2 Q12908 13/20 0.41
HTT P42858 2/20 0.36
MAPT P10636 1/20 0.36
RAB9A P51151 1/20 0.36
PDE4A P27815 1/20 0.36
PDE4B Q07343 1/20 0.36
PDE4C Q08493 1/20 0.36
PDE4D Q08499 1/20 0.36
MEN1 O00255 1/20 0.35
KMT2A Q03164 1/20 0.35
CTSG P08311 1/20 0.34
CMA1 P23946 1/20 0.34

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
SCHEMBL8015441 0.92 SLC10A2 (0.48) SLC10A2
SCHEMBL8015641 0.91 SLC10A2 (0.35) SLC10A2HTTMAPTRAB9AMEN1
SCHEMBL21585933 0.91 SLC10A2 (0.37) SLC10A2HTTMAPTRAB9AMEN1
SCHEMBL8030524 0.91 SLC10A2 (0.37) SLC10A2HTTMAPTRAB9AMEN1
SCHEMBL30912780 0.91 SLC10A2 (0.37) SLC10A2HTTMAPTRAB9AMEN1
SCHEMBL22286477 0.85 SLC10A2 (0.39) SLC10A2
SCHEMBL22286548 0.85 SLC10A2 (0.39) SLC10A2
SCHEMBL29862328 0.85 SLC10A2 (0.39) SLC10A2
SCHEMBL8014446 0.85 SLC10A2 (0.42) SLC10A2HTTMAPTKMT2A
SCHEMBL27118537 0.85 SLC10A2 (0.51) SLC10A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0792268-B1 HYPOLIPIDEMIC BENZOTHIAZEPINES WELLCOME FOUND (GB) 2000-02-23 EP claimed
US-5998400-A Hypolipidemic benzothiazepines GLAXO WELLCOME INC. (US) 1999-12-07 US claimed
EP-0792268-A1 HYPOLIPIDEMIC BENZOTHIAZEPINES THE WELLCOME FOUNDATION LIMITED (GB) 1997-09-03 EP claimed
WO-1996016051-A1 HYPOLIPIDEMIC BENZOTHIAZEPINES THE WELLCOME FOUNDATION LIMITED (GB) 1996-05-30 WO claimed
EP-0792268-B1 HYPOLIPIDEMIC BENZOTHIAZEPINES WELLCOME FOUND (GB) 2000-02-23 EP disclosed
US-5998400-A Hypolipidemic benzothiazepines GLAXO WELLCOME INC. (US) 1999-12-07 US disclosed
EP-0792268-A1 HYPOLIPIDEMIC BENZOTHIAZEPINES THE WELLCOME FOUNDATION LIMITED (GB) 1997-09-03 EP disclosed
WO-1996016051-A1 HYPOLIPIDEMIC BENZOTHIAZEPINES THE WELLCOME FOUNDATION LIMITED (GB) 1996-05-30 WO disclosed