SCHEMBL8015641

SCHEMBL8015641

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

nearest known ligand 0.36

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
SLC10A2 Q12908 13/20 0.35
MAPT P10636 3/20 0.34
MEN1 O00255 2/20 0.34
KMT2A Q03164 2/20 0.34
L3MBTL1 Q9Y468 1/20 0.34
HTT P42858 1/20 0.34
RAB9A P51151 1/20 0.34
TP53 P04637 1/20 0.33
GAA P10253 1/20 0.33
KDM4E B2RXH2 1/20 0.33
LMNA P02545 1/20 0.33
CYP3A4 P08684 1/20 0.33
HPGD P15428 1/20 0.33
RECQL P46063 1/20 0.33
HSD17B10 Q99714 1/20 0.33

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
SCHEMBL5228945 0.92 SLC10A2 (0.42) SLC10A2
SCHEMBL8014222 0.91 SLC10A2 (0.41) SLC10A2MAPTMEN1KMT2AHTT
SCHEMBL5227832 0.90 SLC10A2 (0.41) SLC10A2
SCHEMBL8026281 0.89 SLC10A2 (0.35) SLC10A2KMT2AL3MBTL1LMNA
SCHEMBL21585933 0.85 SLC10A2 (0.37) SLC10A2MAPTMEN1KMT2AHTT
SCHEMBL8030524 0.85 SLC10A2 (0.37) SLC10A2MAPTMEN1KMT2AHTT
SCHEMBL21586031 0.85 SLC10A2 (0.33) SLC10A2
SCHEMBL21585930 0.85 SLC10A2 (0.33) SLC10A2MAPT
SCHEMBL30912771 0.85 SLC10A2 (0.33) SLC10A2MAPT
SCHEMBL8015441 0.83 SLC10A2 (0.48) 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 7 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
WO-1996016051-A1 HYPOLIPIDEMIC BENZOTHIAZEPINES THE WELLCOME FOUNDATION LIMITED (GB) 1996-05-30 WO disclosed