SCHEMBL4955185

SCHEMBL4955185

CCN1C[C@H](NS(=O)(=O)C(C)C)[C@@H](c2ccc(-c3ccc(C#N)cc3)cc2)C1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
GRIA2 P42262 19/20 1.00
KCNH2 Q12809 13/20 1.00
GRIA4 P48058 2/20 0.60
GRIA1 P42261 1/20 0.46
GRIA3 P42263 1/20 0.46

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
SCHEMBL4955198 1.00 GRIA2 (1.00) GRIA2KCNH2GRIA4GRIA1GRIA3
SCHEMBL5451246 1.00 GRIA2 (1.00) GRIA2KCNH2GRIA4GRIA1GRIA3
SCHEMBL5186693 0.88 GRIA2 (0.88) GRIA2KCNH2GRIA4
SCHEMBL5186675 0.88 GRIA2 (0.88) GRIA2KCNH2GRIA4
SCHEMBL5186679 0.88 GRIA2 (0.88) GRIA2KCNH2GRIA4
SCHEMBL5186688 0.88 GRIA2 (0.88) GRIA2KCNH2GRIA4
SCHEMBL4958664 0.86 GRIA2 (1.00) GRIA2KCNH2GRIA4
SCHEMBL15933105 0.86 GRIA2 (1.00) GRIA2KCNH2GRIA4
SCHEMBL4958666 0.86 GRIA2 (1.00) GRIA2KCNH2GRIA4
SCHEMBL5451223 0.86 GRIA2 (1.00) GRIA2KCNH2GRIA4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20070270471-A1 Compounds Which Potentiate Glutamate Receptor and Uses Thereof in Medicine GLAXO GROUP LIMITED (GB) 2007-11-22 US claimed
US-20080139472-A1 UPREGULATING BDNF LEVELS TO MITIGATE MENTAL RETARDATION THE REGENTS OF THE UNIVERSITY OF CALIFORNIA 2008-06-12 US disclosed
US-20070270471-A1 Compounds Which Potentiate Glutamate Receptor and Uses Thereof in Medicine GLAXO GROUP LIMITED (GB) 2007-11-22 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 (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 GRIA2 43/4885KCNH2 4187/4885GRIA4 53/4885
US-20070270471-A1 Compounds Which Potentiate Glutamate Receptor and Uses Thereof in Medicine GRM3, GLRA3, GLRA1 GRIA2 34/4885KCNH2 562/4885GRIA4 46/4885

“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.