SCHEMBL1553347

SCHEMBL1553347

O=C(c1c[nH]c2ccccc12)N1CCS(=O)(=O)CC1

nearest known ligand 0.68

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GFER P55789 1/20 0.65
HTT P42858 1/20 0.61
MAPK14 Q16539 1/20 0.61
AVPR1A P37288 1/20 0.54
POLB P06746 1/20 0.53
GPR84 Q9NQS5 1/20 0.53
GAA P10253 1/20 0.52
HDAC1 Q13547 1/20 0.52
HDAC6 Q9UBN7 1/20 0.52
ALDH1A1 P00352 4/20 0.51
KDM4E B2RXH2 1/20 0.51
LMNA P02545 1/20 0.51
DRD2 P14416 1/20 0.51
DRD3 P35462 1/20 0.51
GABRA1 P14867 2/20 0.50
GABRG2 P18507 2/20 0.50
GABRB3 P28472 2/20 0.50
GABRA3 P34903 2/20 0.50
GABRA2 P47869 2/20 0.50
GABRB2 P47870 2/20 0.50

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
SCHEMBL28481273 0.85 GFER (0.68) GFERHTTMAPK14AVPR1APOLB
SCHEMBL948677 0.84 GFER (0.71) GFERHTTMAPK14AVPR1APOLB
SCHEMBL289605 0.84 POLB (0.74) GFERHTTMAPK14AVPR1APOLB
SCHEMBL1144650 0.82 GFER (0.68) GFERHTTMAPK14AVPR1APOLB
SCHEMBL9410743 0.81 GFER (0.71) GFERHTTMAPK14AVPR1APOLB
SCHEMBL8708978 0.81 GFER (0.67) GFERHTTMAPK14AVPR1APOLB
SCHEMBL8707863 0.81 GFER (0.67) GFERHTTMAPK14AVPR1APOLB
SCHEMBL20181880 0.81 ALDH1A1 (0.75) GFERHTTMAPK14AVPR1APOLB
SCHEMBL8445235 0.79 GFER (1.00) GFERHTTMAPK14AVPR1APOLB
SCHEMBL8984788 0.79 GFER (0.67) GFERHTTMAPK14AVPR1APOLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-101316838-B 1,1-dioxo-thiomorpholinyl indolyl methanone derivatives for use as h3 modulators HOFFMANN LA ROCHE 2013-01-30 CN disclosed
CN-101316838-B 1,1-dioxo-thiomorpholinyl indolyl methanone derivatives for use as h3 modulators HOFFMANN LA ROCHE 2013-01-30 CN disclosed
EP-1968967-B1 1,1-DIOXO-THIOMORPHOLINYL INDOLYL METHANONE DERIVATIVES FOR USE AS H3 MODULATORS HOFFMANN LA ROCHE (CH) 2011-04-27 EP disclosed
US-7538101-B2 1,1-dioxo-thiomorpholinyl indolyl methanone derivatives HOFFMANN-LA ROCHE INC. (US) 2009-05-26 US disclosed
US-7538101-B2 1,1-dioxo-thiomorpholinyl indolyl methanone derivatives HOFFMANN-LA ROCHE INC. (US) 2009-05-26 US disclosed
CN-101316838-A 1,1-dioxo-thiomorpholinyl indolyl methanone derivatives for use as h3 modulators HOFFMANN LA ROCHE (CH) 2008-12-03 CN disclosed
CN-101316838-A 1,1-dioxo-thiomorpholinyl indolyl methanone derivatives for use as h3 modulators HOFFMANN LA ROCHE (CH) 2008-12-03 CN disclosed
EP-1968967-A1 1,1-DIOXO-THIOMORPHOLINYL INDOLYL METHANONE DERIVATIVES FOR USE AS H3 MODULATORS F.HOFFMANN-LA ROCHE AG (CH) 2008-09-17 EP disclosed
WO-2007062997-A1 1,1-DIOXO-THIOMORPHOLINYL INDOLYL METHANONE DERIVATIVES FOR USE AS H3 MODULATORS F. HOFFMANN-LA ROCHE AG (CH) 2007-06-07 WO disclosed
US-20070123526-A1 1,1-Dioxo-thiomorpholinyl indolyl methanone derivatives F. HOFFMANN-LA ROCHE AG (CH) 2007-05-31 US disclosed
US-20070123526-A1 1,1-Dioxo-thiomorpholinyl indolyl methanone derivatives F. HOFFMANN-LA ROCHE AG (CH) 2007-05-31 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20070123526-A1 1,1-Dioxo-thiomorpholinyl indolyl methanone derivatives MTNR1A, HTR1A, HRH4 GFER 2885/4885HTT 713/4885MAPK14 3274/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.