SCHEMBL20204331

SCHEMBL20204331

Cc1sc2nc(Cc3cccc(C(F)(F)F)c3F)cc(=O)n2c1C(=O)NCC(C)C(C)C

nearest known ligand 0.80

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
GRIN1 Q05586 20/20 0.80
GRIN2A Q12879 20/20 0.80
GRIA2 P42262 8/20 0.80

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
SCHEMBL16636547 0.89 GRIN1 (1.00) GRIN1GRIN2AGRIA2
SCHEMBL16637478 0.88 GRIN1 (0.85) GRIN1GRIN2AGRIA2
SCHEMBL17958277 0.88 GRIN1 (0.79) GRIN1GRIN2AGRIA2
SCHEMBL16645790 0.88 GRIN1 (0.85) GRIN1GRIN2AGRIA2
SCHEMBL20403456 0.87 GRIN1 (0.87) GRIN1GRIN2AGRIA2
SCHEMBL16645596 0.87 GRIN1 (0.82) GRIN1GRIN2AGRIA2
SCHEMBL17958270 0.86 GRIN1 (0.76) GRIN1GRIN2AGRIA2
SCHEMBL16645971 0.86 GRIN1 (0.79) GRIN1GRIN2AGRIA2
SCHEMBL17958247 0.86 GRIN1 (0.79) GRIN1GRIN2AGRIA2
SCHEMBL17958128 0.86 GRIN1 (0.79) 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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9988400-B2 Thiazolopyrimidinones and methods of use thereof GENENTECH, INC. (US) 2018-06-05 US claimed