SCHEMBL21653389

SCHEMBL21653389

O=C(Nc1cc(F)c(=O)n(CC(F)F)c1)c1cc(Cl)c(C#CCO)s1

nearest known ligand 0.32

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ MET P08581 1/20 0.32
▸ AXL P30530 1/20 0.32
▸ MAPT P10636 3/20 0.31
▸ MAPK1 P28482 1/20 0.31
▸ TP53 P04637 1/20 0.31

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
SCHEMBL21653146 0.87 MET (0.33) METAXLMAPTMAPK1TP53
SCHEMBL21653041 0.87 MAPT (0.34) METAXLMAPTMAPK1TP53
SCHEMBL21652918 0.84 GSK3B (0.36) METAXLMAPTMAPK1TP53
SCHEMBL21653248 0.82 MET (0.34) METAXLMAPTMAPK1TP53
SCHEMBL21653326 0.82 CYP2C9 (0.40) METAXLMAPTMAPK1
SCHEMBL21633837 0.80 MAPT (0.39) METAXLMAPTMAPK1
SCHEMBL21653010 0.78 MEN1 (0.32) METAXLMAPTMAPK1
SCHEMBL21653050 0.77 AR (0.35) MAPTMAPK1TP53
SCHEMBL21652863 0.76 MAPT (0.32) METAXLMAPT
SCHEMBL21653151 0.76 PDE10A (0.35) MAPTMAPK1TP53

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-2020023657-A1 PYRIDIN-2-ONE COMPOUNDS USEFUL AS SMARCA2 ANTAGONISTS Epizyme, Inc. (US) 2020-01-30 — — WO disclosed
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