SCHEMBL16645967

SCHEMBL16645967

Cc1sc2nc(Cc3cc(F)c(F)cc3C3CC3)cc(=O)n2c1C(N)=O

nearest known ligand 0.54

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
GRIN2A Q12879 20/20 0.54
GRIN1 Q05586 19/20 0.54
GRIA2 P42262 10/20 0.45

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
SCHEMBL17958198 0.87 GRIN1 (0.72) GRIN2AGRIN1GRIA2
SCHEMBL16645502 0.83 GRIN1 (0.47) GRIN2AGRIN1GRIA2
SCHEMBL16645505 0.83 GRIN1 (0.62) GRIN2AGRIN1GRIA2
SCHEMBL20403443 0.81 GRIN1 (0.49) GRIN2AGRIN1GRIA2
SCHEMBL16645488 0.77 GRIN1 (0.51) GRIN2AGRIN1GRIA2
SCHEMBL16645794 0.76 GRIN1 (0.77) GRIN2AGRIN1GRIA2
SCHEMBL16645487 0.76 GRIN1 (0.61) GRIN2AGRIN1GRIA2
SCHEMBL16636615 0.74 GRIN1 (0.62) GRIN2AGRIN1GRIA2
SCHEMBL16645810 0.74 GRIN2A (0.58) GRIN2AGRIN1GRIA2
SCHEMBL16636460 0.74 GRIN1 (0.77) GRIN2AGRIN1GRIA2

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

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