SCHEMBL19258476

SCHEMBL19258476

Nc1nc(-n2ncc3ncc(F)cc32)ncc1F

nearest known ligand 0.33

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
GRIN1 Q05586 9/20 0.33
GRIN2B Q13224 9/20 0.33

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
SCHEMBL19250590 0.86 GRIN1 (0.34) GRIN1GRIN2B
SCHEMBL19258560 0.84 GRIN1 (0.34) GRIN1GRIN2B
SCHEMBL19258556 0.83 MAP3K14 (0.30)
SCHEMBL19258987 0.81 GRIN1 (0.35) GRIN1GRIN2B
SCHEMBL19259012 0.78 MEN1 (0.32) GRIN2B
SCHEMBL19258499 0.75 PDE10A (0.34)
SCHEMBL19259114 0.73 NPC1 (0.34) GRIN1GRIN2B
SCHEMBL19258473 0.71 KMT2A (0.37)
SCHEMBL29439025 0.69 PIK3CA (0.41)
SCHEMBL2361171 0.66 GRIN1 (0.45) GRIN1GRIN2B

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-2017133657-A1 PYRIDINE AND PYRIMIDINE DERIVATIVES AND THEIR USE IN TREATMENT, AMELIORATION OR PREVENTION OF INFLUENZA SAVIRA PHARMACEUTICALS GMBH (AT) 2017-08-10 WO disclosed