SCHEMBL16645863

SCHEMBL16645863

Cc1sc2nc(COc3ccc([SiH3])cc3)cc(=O)n2c1-c1nnc[nH]1

nearest known ligand 0.47

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
GRIN2A Q12879 3/20 0.47
GRIN1 Q05586 2/20 0.47
GRIA2 P42262 1/20 0.45
MAPT P10636 12/20 0.44
POLB P06746 3/20 0.41
RXFP1 Q9HBX9 5/20 0.40
TP53 P04637 2/20 0.39
SMN1; SMN2 Q16637 1/20 0.39

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
SCHEMBL16637440 0.91 GRIN2A (0.58) GRIN2AGRIN1GRIA2MAPTPOLB
SCHEMBL17958139 0.74 GRIN2A (0.56) GRIN2AGRIN1GRIA2MAPTPOLB
SCHEMBL16637670 0.70 GRIN2A (0.58) GRIN2AGRIN1GRIA2MAPTPOLB
SCHEMBL16645434 0.69 GRIN2A (0.59) GRIN2AGRIN1GRIA2MAPTPOLB
SCHEMBL16636630 0.68 GRIN2A (0.67) GRIN2AGRIN1GRIA2MAPTPOLB
SCHEMBL16637168 0.68 GRIN2A (0.66) GRIN2AGRIN1GRIA2MAPTPOLB
SCHEMBL16637445 0.67 GRIN2A (0.65) GRIN2AGRIN1GRIA2MAPTPOLB
SCHEMBL16636830 0.67 GRIN2A (0.68) GRIN2AGRIN1GRIA2MAPTPOLB
SCHEMBL16637032 0.67 GRIN2A (0.76) GRIN2AGRIN1GRIA2MAPTPOLB
SCHEMBL16637050 0.67 GRIN2A (0.64) GRIN2AGRIN1GRIA2MAPTPOLB

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