SCHEMBL21653131

SCHEMBL21653131

CN(C)C(=O)c1sc(C(=O)Nc2cc(F)c(=O)n(CCF)c2)cc1Cl

nearest known ligand 0.35

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 5/20 0.35
▸ MAPK1 P28482 1/20 0.35
▸ FSCN1 Q16658 1/20 0.32
▸ KMT2A Q03164 3/20 0.32
▸ MEN1 O00255 2/20 0.32
▸ TP53 P04637 1/20 0.31
▸ HSD17B10 Q99714 1/20 0.31
▸ ALDH1A1 P00352 1/20 0.30
▸ TDP1 Q9NUW8 1/20 0.30
▸ PDE7A Q13946 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
SCHEMBL21653164 0.84 MAPT (0.37) MAPTMAPK1FSCN1KMT2AMEN1
SCHEMBL21653130 0.82 MAPT (0.35) MAPTMAPK1FSCN1KMT2AMEN1
SCHEMBL21653148 0.81 MAPT (0.36) MAPTMAPK1FSCN1KMT2AMEN1
SCHEMBL21653256 0.80 MAPT (0.34) MAPTMAPK1FSCN1KMT2AMEN1
SCHEMBL21653186 0.78 RAB9A (0.40) MAPTKMT2ATP53ALDH1A1TDP1
SCHEMBL21653141 0.78 MAPT (0.36) MAPTMAPK1FSCN1KMT2AMEN1
SCHEMBL21653244 0.76 BACE1 (0.39) MAPTMAPK1FSCN1KMT2AMEN1
SCHEMBL21653074 0.76 GSK3B (0.38) MAPTMAPK1KMT2AMEN1HSD17B10
SCHEMBL21653156 0.75 PDE10A (0.38) MAPTMAPK1KMT2AMEN1TP53
SCHEMBL21652914 0.75 MAPT (0.31) MAPTKMT2AMEN1HSD17B10ALDH1A1

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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