SCHEMBL8026281

SCHEMBL8026281

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

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SLC10A2 Q12908 8/20 0.35
TMEM97 Q5BJF2 4/20 0.33
HTR7 P34969 3/20 0.33
HTR2B P41595 3/20 0.33
SIGMAR1 Q99720 3/20 0.33
HTR1A P08908 2/20 0.33
SLC6A2 P23975 2/20 0.33
ADRA2A P08913 1/20 0.33
ADRB3 P13945 1/20 0.33
ADRA2B P18089 1/20 0.33
DRD4 P21917 1/20 0.33
HTR2C P28335 1/20 0.33
ADRA1A P35348 1/20 0.33
SLC6A3 Q01959 1/20 0.33
HRH3 Q9Y5N1 1/20 0.33
GLA P06280 1/20 0.31
L3MBTL1 Q9Y468 1/20 0.31
LMNA P02545 1/20 0.31
PLA2G1B P04054 1/20 0.31
TSHR P16473 1/20 0.31

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
SCHEMBL8014474 0.91 SLC10A2 (0.40) SLC10A2ELANE
SCHEMBL21586031 0.91 SLC10A2 (0.33) SLC10A2TMEM97HTR7HTR2BSIGMAR1
SCHEMBL21585930 0.91 SLC10A2 (0.33) SLC10A2TMEM97HTR7HTR2BSIGMAR1
SCHEMBL21585932 0.89 NR1H4 (0.35) SLC10A2TMEM97HTR7HTR2BSIGMAR1
SCHEMBL8015641 0.89 SLC10A2 (0.35) SLC10A2L3MBTL1LMNAKMT2A
SCHEMBL8026263 0.87 SLC10A2 (0.41) SLC10A2TMEM97HTR7HTR2BSIGMAR1
SCHEMBL8014222 0.83 SLC10A2 (0.41) SLC10A2KMT2A
SCHEMBL8028411 0.83 TMEM97 (0.39) SLC10A2TMEM97HTR7HTR2BSIGMAR1
SCHEMBL23451470 0.83 NR1H4 (0.36) SLC10A2
SCHEMBL22286479 0.83 SLC10A2 (0.38) SLC10A2ELANE

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