SCHEMBL1977428

SCHEMBL1977428

O=S1(=O)NCCNc2ccc(Oc3ccc(F)cc3)cc21

nearest known ligand 0.40

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
GRIA2 P42262 11/20 0.40
USP2 O75604 1/20 0.37
ALDH1A1 P00352 1/20 0.37
CA1 P00915 3/20 0.36
CA2 P00918 3/20 0.36
CA12 O43570 2/20 0.36
CA4 P22748 2/20 0.36
CA7 P43166 2/20 0.36
CA9 Q16790 2/20 0.36
SCN4A P35499 1/20 0.36
VEGFA P15692 1/20 0.35
ABCC8 Q09428 1/20 0.34
KCNJ11 Q14654 1/20 0.34
SOS1 Q07889 1/20 0.33

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
SCHEMBL1980510 0.90 VEGFA (0.45) GRIA2CA1CA2CA12CA4
SCHEMBL1979031 0.88 GRIA2 (0.41) GRIA2VEGFA
SCHEMBL1967915 0.87 GRIA2 (0.53) GRIA2
SCHEMBL1971790 0.86 GRIA2 (0.40) GRIA2CA1CA2CA12CA4
SCHEMBL1970203 0.86 GRIA2 (0.40) GRIA2ALDH1A1ABCC8KCNJ11
Hydrochloric Acid SCHEMBL2811105 0.85 GRIA2 (0.40) GRIA2ALDH1A1
SCHEMBL1982798 0.82 ADAM17 (0.46) GRIA2ALDH1A1ABCC8KCNJ11
SCHEMBL1978280 0.80 GRIA2 (0.44) GRIA2
SCHEMBL1981334 0.80 CA2 (0.54) GRIA2ALDH1A1CA1CA2CA12
SCHEMBL3761028 0.78 GRIA2 (0.40) GRIA2CA1CA2CA12CA4

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-8236790-B2 Benzothiadiazepine compounds, a process for their preparation and pharmaceutical compositions containing them LES LABORATORIES SERVIER (FR) 2012-08-07 US disclosed
EP-2246339-B1 Derivatives of benzothiazepine and their use as modulators of AMPA and NMDA receptors SERVIER LAB (FR) 2011-06-22 EP disclosed
EP-2246339-A1 Derivatives of benzothiazepine and their use as modulators of AMPA and NMDA receptors Les Laboratoires Servier (FR) 2010-11-03 EP disclosed
WO-2010106249-A1 BENZOTHIADIAZEPINE DERIVATIVES USED AS AMPA AND NMDA RECEPTOR MODULATORS LES LABORATOIRES SERVIER (FR) 2010-09-23 WO disclosed
US-20100240635-A1 Benzothiadiazepine compounds, a process for their preparation and pharmaceutical compositions containing them LES LABORATOIRES SERVIER (FR) 2010-09-23 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-20100240635-A1 Benzothiadiazepine compounds, a process for their preparation and pharmaceutical compositions containing them GRIN1, GRIN2B, GRIN3A GRIA2 45/4885USP2 3066/4885ALDH1A1 2046/4885

“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.