SCHEMBL756186

SCHEMBL756186

N=C(NO)c1cccc(Oc2ccc3c(c2)S(O)(O)NCCO3)c1

nearest known ligand 0.34

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
HDAC8 Q9BY41 1/20 0.34
CTNNB1 P35222 1/20 0.33
WNT3A P56704 1/20 0.33
KEAP1 Q14145 1/20 0.32
NPC1 O15118 4/20 0.32
RAB9A P51151 4/20 0.32
ALDH1A1 P00352 2/20 0.32
SMN1; SMN2 Q16637 2/20 0.32
PKM P14618 1/20 0.32
FAAH O00519 1/20 0.31
F2 P00734 3/20 0.31
F10 P00742 3/20 0.31
FURIN P09958 1/20 0.31
KDM4E B2RXH2 1/20 0.30
LMNA P02545 1/20 0.30
POLB P06746 1/20 0.30
RIPK1 Q13546 1/20 0.30
ERCC5 P28715 1/20 0.30
FEN1 P39748 1/20 0.30

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
SCHEMBL760980 0.84 AKR1C3 (0.48) CTNNB1WNT3ANPC1RAB9AALDH1A1
SCHEMBL756187 0.81 LMNA (0.35) CTNNB1WNT3AKEAP1FAAHF2
SCHEMBL756184 0.81 LMNA (0.35) CTNNB1WNT3AKEAP1FAAHF2
SCHEMBL1973353 0.81 HDAC8 (0.35) HDAC8NPC1F2F10FURIN
SCHEMBL762297 0.80 GRIA2 (0.45) KEAP1NPC1RAB9AALDH1A1SMN1; SMN2
SCHEMBL757861 0.78 KDM4E (0.39) HDAC8CTNNB1WNT3ANPC1RAB9A
SCHEMBL760930 0.73 TDP1 (0.41) ALDH1A1SMN1; SMN2PKMKDM4EPOLB
SCHEMBL760979 0.73 KEAP1 (0.48) KEAP1NPC1RAB9AFAAHKDM4E
SCHEMBL5479492 0.71 GRIA2 (0.38) HDAC8
SCHEMBL756185 0.69 KEAP1 (0.44) HDAC8CTNNB1WNT3AKEAP1NPC1

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 4 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
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 HDAC8 1383/4885CTNNB1 2961/4885WNT3A 4499/4885

“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.