SCHEMBL2215913

SCHEMBL2215913

COc1cccc(-c2ccc([C@@H]3C[C@H]3NS(=O)(=O)C(C)C)cc2)c1

nearest known ligand 0.54

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
KDM1A O60341 5/20 0.54
MAOA P21397 2/20 0.54
MAOB P27338 2/20 0.54
GRIA2 P42262 14/20 0.53
KCNH2 Q12809 10/20 0.52

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
SCHEMBL2215911 1.00 KDM1A (0.54) KDM1AMAOAMAOBGRIA2KCNH2
SCHEMBL12514031 1.00 KDM1A (0.54) KDM1AMAOAMAOBGRIA2KCNH2
SCHEMBL2215179 0.83 GRIA4 (0.57) KDM1AMAOAMAOBGRIA2KCNH2
SCHEMBL2216216 0.83 GRIA4 (0.57) KDM1AMAOAMAOBGRIA2KCNH2
SCHEMBL12513941 0.78 GRIA2 (0.50) KDM1AGRIA2KCNH2
SCHEMBL2215518 0.77 GRIA2 (0.56) GRIA2KCNH2
SCHEMBL12513978 0.77 GRIA2 (0.56) GRIA2KCNH2
SCHEMBL2215515 0.77 GRIA2 (0.56) GRIA2KCNH2
SCHEMBL2211452 0.77 GRIA2 (0.54) KDM1AMAOAMAOBGRIA2KCNH2
SCHEMBL2211455 0.77 GRIA2 (0.54) KDM1AMAOAMAOBGRIA2KCNH2

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 9 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-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
US-20080139472-A1 UPREGULATING BDNF LEVELS TO MITIGATE MENTAL RETARDATION THE REGENTS OF THE UNIVERSITY OF CALIFORNIA 2008-06-12 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 (2 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-20080139472-A1 UPREGULATING BDNF LEVELS TO MITIGATE MENTAL RETARDATION BDNF, MECP2, NTRK2 KDM1A 1854/4885MAOA 2566/4885MAOB 2822/4885
US-20080167351-A1 Compounds Which Potentiate Glutamate Receptor and Uses Thereof in Medicine GRIN1, GRM2, GRM1 KDM1A 3326/4885MAOA 2383/4885MAOB 1930/4885

“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.