SCHEMBL16645478

SCHEMBL16645478

Cc1sc2nc(Cc3cccc(C#N)c3F)cc(=O)n2c1C(N)=O

nearest known ligand 0.77

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
GRIN1 Q05586 20/20 0.77
GRIN2A Q12879 20/20 0.77
GRIA2 P42262 9/20 0.67

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
SCHEMBL16645922 0.91 GRIN1 (0.79) GRIN1GRIN2AGRIA2
SCHEMBL16637960 0.91 GRIN1 (0.79) GRIN1GRIN2AGRIA2
SCHEMBL16637862 0.90 GRIN1 (0.85) GRIN1GRIN2AGRIA2
SCHEMBL17958083 0.90 GRIN1 (0.79) GRIN1GRIN2AGRIA2
SCHEMBL16637259 0.88 GRIN1 (0.77) GRIN1GRIN2AGRIA2
SCHEMBL16645602 0.87 GRIN1 (1.00) GRIN1GRIN2AGRIA2
SCHEMBL16636241 0.86 GRIN1 (0.71) GRIN1GRIN2AGRIA2
SCHEMBL20204345 0.86 GRIN1 (0.79) GRIN1GRIN2AGRIA2
SCHEMBL16645470 0.85 GRIN1 (0.83) GRIN1GRIN2AGRIA2
SCHEMBL16636460 0.84 GRIN1 (0.77) GRIN1GRIN2AGRIA2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3055315-B1 THIAZOLOPYRIMIDINONES AS MODULATORS OF NMDA RECEPTOR ACTIVITY HOFFMANN LA ROCHE (CH) 2018-07-25 EP disclosed
WO-2015052226-A1 THIAZOLOPYRIMIDINONES AS MODULATORS OF NMDA RECEPTOR ACTIVITY F. HOFFMANN-LA ROCHE AG (CH) 2015-04-16 WO disclosed