SCHEMBL758224

SCHEMBL758224

O=S1(=O)NCCOc2ccc(Oc3cccc(-c4nccs4)c3)cc21

nearest known ligand 0.42

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
KEAP1 Q14145 1/20 0.42
FFAR1 O14842 1/20 0.35
SYK P43405 3/20 0.34
GRIA2 P42262 4/20 0.34
SCN9A Q15858 1/20 0.34
CARM1 Q86X55 1/20 0.33
PDPK1 O15530 1/20 0.33
GPR119 Q8TDV5 1/20 0.33
PIK3CD O00329 1/20 0.33
ABL1 P00519 1/20 0.33
BCR P11274 1/20 0.33
GAA P10253 1/20 0.33
NTRK1 P04629 1/20 0.33
PRKDC P78527 1/20 0.33
THRA P10827 1/20 0.32
THRB P10828 1/20 0.32

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
SCHEMBL757739 0.81 KEAP1 (0.43) KEAP1GRIA2GPR119PIK3CD
SCHEMBL765578 0.80 KEAP1 (0.42) KEAP1GRIA2PIK3CD
SCHEMBL760502 0.79 FFAR1 (0.38) FFAR1SYKSCN9ACARM1PIK3CD
SCHEMBL753235 0.78 KEAP1 (0.60) KEAP1FFAR1GRIA2
SCHEMBL757752 0.77 KEAP1 (0.42) KEAP1GRIA2GAA
SCHEMBL757397 0.76 RAB9A (0.46) KEAP1GRIA2SCN9AGAA
SCHEMBL760208 0.76 KEAP1 (0.41) KEAP1GRIA2PIK3CDGAA
SCHEMBL762296 0.75 GRIA2 (0.55) KEAP1FFAR1GRIA2
SCHEMBL782217 0.75 GPR119 (0.38) FFAR1CARM1GPR119PIK3CDABL1
SCHEMBL760979 0.74 KEAP1 (0.48) KEAP1GRIA2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8569285-B2 Dihydrobenzoxathiazepine compounds, a process for their preparation and pharmaceutical compositions containing them LES LABORATOIRES SERVIER (FR) 2013-10-29 US disclosed
EP-2431360-B1 Derivatives of dihydrobenzoxathiazepine, method of preparing same and pharmaceutical compositions containing them as well as their uses as modulators of AMPA receptors SERVIER LAB (FR) 2013-04-17 EP disclosed
WO-2012035216-A1 DIHYDROBENZOXATHIAZEPINE DERIVATIVES, PREPARATION THEREOF, PHARMACEUTICAL COMPOSITIONS AND USE AS AMPA RECEPTOR MODULATORS LES LABORATOIRES SERVIER (FR) 2012-03-22 WO disclosed
US-20120071462-A1 Dihydrobenzoxathiazepine compounds, a process for their preparation and pharmaceutical compositions containing them LES LABORATOIRES SERVIER (FR) 2012-03-22 US disclosed
EP-2431360-A1 Derivatives of dihydrobenzoxathiazepine, method of preparing same and pharmaceutical compositions containing them as well as their uses as modulators of AMPA receptors Les Laboratoires Servier (FR) 2012-03-21 EP 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-20120071462-A1 Dihydrobenzoxathiazepine compounds, a process for their preparation and pharmaceutical compositions containing them GABRA1, GRM1, GABRA5 KEAP1 2482/4885FFAR1 217/4885SYK 2038/4885

“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.