SCHEMBL16645618

SCHEMBL16645618

CCN(Cc1cc(=O)n2c(C(N)=O)c(C(F)(F)F)sc2n1)c1ccc(F)cc1

nearest known ligand 0.67

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
GRIN2A Q12879 20/20 0.67
GRIN1 Q05586 19/20 0.67
GRIA2 P42262 17/20 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
SCHEMBL16645492 0.88 GRIN2A (0.65) GRIN2AGRIN1GRIA2
SCHEMBL17958212 0.88 GRIN2A (0.79) GRIN2AGRIN1GRIA2
SCHEMBL16645622 0.87 GRIN2A (0.83) GRIN2AGRIN1GRIA2
SCHEMBL16637197 0.81 GRIN2A (0.82) GRIN2AGRIN1GRIA2
SCHEMBL16637823 0.81 GRIN2A (1.00) GRIN2AGRIN1GRIA2
SCHEMBL16636233 0.79 GRIN1 (1.00) GRIN2AGRIN1GRIA2
SCHEMBL17958156 0.79 GRIN2A (0.69) GRIN2AGRIN1GRIA2
SCHEMBL17958159 0.79 GRIN2A (0.69) GRIN2AGRIN1GRIA2
SCHEMBL16645811 0.78 GRIN2A (0.80) GRIN2AGRIN1GRIA2
SCHEMBL16645452 0.78 GRIN1 (1.00) 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