SCHEMBL16637368

SCHEMBL16637368

CCN(Cc1cc(=O)n2c(C3=CC=C3)c(C)sc2n1)c1ccc(F)cc1

nearest known ligand 0.72

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
GRIN2A Q12879 20/20 0.72
GRIN1 Q05586 19/20 0.72
GRIA2 P42262 17/20 0.72

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
SCHEMBL16645874 0.86 GRIN2A (0.81) GRIN2AGRIN1GRIA2
SCHEMBL16636288 0.85 GRIN2A (0.81) GRIN2AGRIN1GRIA2
SCHEMBL16636275 0.85 GRIN2A (0.77) GRIN2AGRIN1GRIA2
SCHEMBL16636283 0.85 GRIN2A (0.77) GRIN2AGRIN1GRIA2
SCHEMBL16645574 0.85 GRIN2A (0.81) GRIN2AGRIN1GRIA2
SCHEMBL16645444 0.84 GRIN2A (0.86) GRIN2AGRIN1GRIA2
SCHEMBL16636719 0.84 GRIN2A (1.00) GRIN2AGRIN1GRIA2
SCHEMBL16645778 0.83 GRIN2A (0.75) GRIN2AGRIN1GRIA2
SCHEMBL16645537 0.83 GRIN2A (0.70) GRIN2AGRIN1GRIA2
SCHEMBL16645569 0.83 GRIN2A (0.70) 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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3055315-A1 THIAZOLOPYRIMIDINONES AS MODULATORS OF NMDA RECEPTOR ACTIVITY F. Hoffmann-La Roche AG (CH) 2016-08-17 EP disclosed
WO-2015052226-A1 THIAZOLOPYRIMIDINONES AS MODULATORS OF NMDA RECEPTOR ACTIVITY F. HOFFMANN-LA ROCHE AG (CH) 2015-04-16 WO disclosed