SCHEMBL21653232

SCHEMBL21653232

N#Cc1sc(C(=O)Nc2cc(F)c(=O)n(CC(F)(F)F)c2)cc1Cl

nearest known ligand 0.34

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 2/20 0.34
▸ MAPK1 P28482 1/20 0.34
▸ AR P10275 8/20 0.33
▸ ENPP2 Q13822 1/20 0.33
▸ IDO1 P14902 1/20 0.31
▸ MEN1 O00255 2/20 0.30
▸ KMT2A Q03164 2/20 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
SCHEMBL21653160 0.92 MEN1 (0.35) MAPTMAPK1ARIDO1MEN1
SCHEMBL21653151 0.90 PDE10A (0.35) MAPTMAPK1ARENPP2MEN1
SCHEMBL21653256 0.87 MAPT (0.34) MAPTMAPK1ARENPP2MEN1
SCHEMBL21653146 0.87 MET (0.33) MAPTMAPK1ARENPP2KMT2A
SCHEMBL21653264 0.86 MAPT (0.36) MAPTMAPK1ARMEN1KMT2A
SCHEMBL21653143 0.85 MAPT (0.36) MAPTMAPK1ARMEN1KMT2A
SCHEMBL21653277 0.84 AR (0.35) MAPTMAPK1ARMEN1KMT2A
SCHEMBL21633859 0.81 LRRK2 (0.38) AR
SCHEMBL21653050 0.79 AR (0.35) MAPTMAPK1AR
SCHEMBL21653072 0.78 KMT2A (0.38) MAPTMAPK1MEN1KMT2A

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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