SCHEMBL2211455

SCHEMBL2211455

COc1ccc(-c2ccc([C@@H]3C[C@H]3NS(=O)(=O)C(C)C)cc2)cn1

nearest known ligand 0.54

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
GRIA2 P42262 13/20 0.54
KCNH2 Q12809 8/20 0.54
KDM1A O60341 2/20 0.54
MAOA P21397 2/20 0.54
MAOB P27338 1/20 0.44
GRIA4 P48058 5/20 0.43

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
SCHEMBL2211452 1.00 GRIA2 (0.54) GRIA2KCNH2KDM1AMAOAMAOB
SCHEMBL13140849 1.00 GRIA2 (0.54) GRIA2KCNH2KDM1AMAOAMAOB
SCHEMBL2213769 0.84 GRIA2 (0.57) GRIA2KCNH2GRIA4
SCHEMBL2213764 0.84 GRIA2 (0.57) GRIA2KCNH2GRIA4
SCHEMBL12513686 0.84 GRIA2 (0.57) GRIA2KCNH2GRIA4
SCHEMBL12513935 0.84 GRIA2 (0.57) GRIA2KCNH2GRIA4
SCHEMBL2213716 0.83 GRIA2 (0.76) GRIA2KCNH2KDM1AGRIA4
SCHEMBL2214548 0.83 GRIA2 (0.76) GRIA2KCNH2KDM1AGRIA4
SCHEMBL12513933 0.83 GRIA2 (0.76) GRIA2KCNH2KDM1AGRIA4
SCHEMBL1873333 0.78 GRIA2 (0.52) GRIA2KCNH2KDM1AMAOA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1848695-B1 COMPOUNDS WHICH POTENTIATE GLUTAMATE RECEPTOR AND USES THEREOF IN MEDICINE GLAXO GROUP LTD (GB) 2011-07-27 EP claimed
US-7790758-B2 glutamate receptors agonists; especially to treat psychotic conditions, including schizophrenia and enhancement of cognition; N-{-2-[4-(6-fluoro-3-pyridinyl)phenyl]cyclopropyl}-2-propanesulfonamide; stereoselectively epoxidising a suitable styrene; coupling with boronic acid derivatives GLAXO GROUP LIMITED (GB) 2010-09-07 US claimed
US-20080167351-A1 Compounds Which Potentiate Glutamate Receptor and Uses Thereof in Medicine GLAXO GROUP LIMITED (GB) 2008-07-10 US claimed
EP-1848695-A1 COMPOUNDS WHICH POTENTIATE GLUTAMATE RECEPTOR AND USES THEREOF IN MEDICINE GLAXO GROUP LIMITED (GB) 2007-10-31 EP claimed
WO-2006087169-A1 COMPOUNDS WHICH POTENTIATE GLUTAMATE RECEPTOR AND USES THEREOF IN MEDICINE GLAXO GROUP LIMITED (GB) 2006-08-24 WO claimed
EP-1848695-B1 COMPOUNDS WHICH POTENTIATE GLUTAMATE RECEPTOR AND USES THEREOF IN MEDICINE GLAXO GROUP LTD (GB) 2011-07-27 EP disclosed
US-7790758-B2 glutamate receptors agonists; especially to treat psychotic conditions, including schizophrenia and enhancement of cognition; N-{-2-[4-(6-fluoro-3-pyridinyl)phenyl]cyclopropyl}-2-propanesulfonamide; stereoselectively epoxidising a suitable styrene; coupling with boronic acid derivatives GLAXO GROUP LIMITED (GB) 2010-09-07 US disclosed
US-20080167351-A1 Compounds Which Potentiate Glutamate Receptor and Uses Thereof in Medicine GLAXO GROUP LIMITED (GB) 2008-07-10 US disclosed
EP-1848695-A1 COMPOUNDS WHICH POTENTIATE GLUTAMATE RECEPTOR AND USES THEREOF IN MEDICINE GLAXO GROUP LIMITED (GB) 2007-10-31 EP disclosed
WO-2006087169-A1 COMPOUNDS WHICH POTENTIATE GLUTAMATE RECEPTOR AND USES THEREOF IN MEDICINE GLAXO GROUP LIMITED (GB) 2006-08-24 WO 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-20080167351-A1 Compounds Which Potentiate Glutamate Receptor and Uses Thereof in Medicine GRIN1, GRM2, GRM1 GRIA2 17/4885KCNH2 1321/4885KDM1A 3326/4885

“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.