SCHEMBL760980

SCHEMBL760980

O=C(O)c1cccc(Oc2ccc3c(c2)S(O)(O)NCCO3)c1

nearest known ligand 0.48

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
AKR1C3 P42330 1/20 0.48
KMO O15229 1/20 0.45
KDM4E B2RXH2 1/20 0.43
PPARG P37231 2/20 0.41
NPC1 O15118 2/20 0.40
POLB P06746 1/20 0.40
CYP2C9 P11712 1/20 0.40
RAB9A P51151 1/20 0.40
FAAH O00519 1/20 0.40
NR1H4 Q96RI1 1/20 0.39
CTNNB1 P35222 1/20 0.39
WNT3A P56704 1/20 0.39
ALDH1A1 P00352 1/20 0.39
MRGPRX4 Q96LA9 1/20 0.38
RIPK1 Q13546 1/20 0.37

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
SCHEMBL760979 0.89 KEAP1 (0.48) AKR1C3KMOKDM4EPPARGNPC1
SCHEMBL756187 0.84 LMNA (0.35) PPARGFAAHCTNNB1WNT3A
SCHEMBL756186 0.84 HDAC8 (0.34) KDM4ENPC1POLBRAB9AFAAH
SCHEMBL756184 0.84 LMNA (0.35) PPARGFAAHCTNNB1WNT3A
SCHEMBL757861 0.83 KDM4E (0.39) KDM4ENPC1POLBRAB9ACTNNB1
SCHEMBL762297 0.83 GRIA2 (0.45) NPC1RAB9AALDH1A1
SCHEMBL1972442 0.79 AKR1C3 (0.50) AKR1C3KMOKDM4ENPC1POLB
SCHEMBL783111 0.75 KEAP1 (0.43) KDM4ENPC1POLBCYP2C9RAB9A
SCHEMBL760930 0.75 TDP1 (0.41) KDM4EPOLBALDH1A1
SCHEMBL753235 0.74 KEAP1 (0.60)

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
US-20120071462-A1 Dihydrobenzoxathiazepine compounds, a process for their preparation and pharmaceutical compositions containing them LES LABORATOIRES SERVIER (FR) 2012-03-22 US 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
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 AKR1C3 844/4885KMO 303/4885KDM4E 788/4885

“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.