SCHEMBL21653248

SCHEMBL21653248

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

nearest known ligand 0.34

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MET P08581 1/20 0.34
▸ AXL P30530 1/20 0.34
▸ MAPT P10636 6/20 0.34
▸ MAPK1 P28482 1/20 0.34
▸ SMN1; SMN2 Q16637 1/20 0.32
▸ KMT2A Q03164 4/20 0.32
▸ TP53 P04637 1/20 0.32
▸ THRB P10828 1/20 0.31
▸ SHMT2 P34897 1/20 0.31
▸ NPC1 O15118 1/20 0.30
▸ LMNA P02545 1/20 0.30
▸ RAB9A P51151 1/20 0.30
▸ MAOA P21397 1/20 0.30
▸ MAOB P27338 1/20 0.30
▸ MEN1 O00255 3/20 0.30
▸ ENPP2 Q13822 3/20 0.30
▸ LPAR1 Q92633 2/20 0.30
▸ CTDSP1 Q9GZU7 2/20 0.30
▸ CYP1A2 P05177 1/20 0.30
▸ TDP1 Q9NUW8 1/20 0.30

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
SCHEMBL21652863 0.90 MAPT (0.32) METAXLMAPTSMN1; SMN2KMT2A
SCHEMBL21652918 0.89 GSK3B (0.36) METAXLMAPTMAPK1SMN1; SMN2
SCHEMBL21633837 0.85 MAPT (0.39) METAXLMAPTMAPK1KMT2A
SCHEMBL21652935 0.84 FSCN1 (0.32) TP53THRBENPP2
SCHEMBL21653146 0.84 MET (0.33) METAXLMAPTMAPK1SMN1; SMN2
SCHEMBL21653010 0.83 MEN1 (0.32) METAXLMAPTMAPK1SMN1; SMN2
SCHEMBL21653389 0.82 MET (0.32) METAXLMAPTMAPK1TP53
SCHEMBL21653062 0.80 MAPT (0.32) METAXLMAPTMAPK1SMN1; SMN2
SCHEMBL21653057 0.80 MAPT (0.37) METAXLMAPTMAPK1KMT2A
SCHEMBL21653021 0.79 MAPT (0.34) METAXLMAPTMAPK1SMN1; SMN2

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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