SCHEMBL21653279

SCHEMBL21653279

CCn1cc(NC(=O)c2cc(C#N)c(Cl)s2)cc(Cl)c1=O

nearest known ligand 0.38

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ USP7 Q93009 3/20 0.38
▸ USP47 Q96K76 3/20 0.38
▸ RORC P51449 3/20 0.37
▸ MAPT P10636 3/20 0.34
▸ TP53 P04637 2/20 0.34
▸ L3MBTL1 Q9Y468 1/20 0.34
▸ RXFP1 Q9HBX9 1/20 0.34
▸ PFKFB2 O60825 1/20 0.33
▸ PFKFB1 P16118 1/20 0.33
▸ PFKFB3 Q16875 1/20 0.33
▸ AR P10275 1/20 0.33
▸ PDE10A Q9Y233 1/20 0.33
▸ SMN1; SMN2 Q16637 1/20 0.33
▸ TAS1R3 Q7RTX0 1/20 0.33
▸ TAS1R1 Q7RTX1 1/20 0.33
▸ TAS1R2 Q8TE23 1/20 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
SCHEMBL21653089 0.89 PDE10A (0.35) USP7USP47MAPTTP53L3MBTL1
SCHEMBL21653276 0.87 L3MBTL1 (0.36) USP7USP47RORCMAPTTP53
SCHEMBL21653120 0.86 GSK3B (0.39) MAPTTP53RXFP1PDE10ASMN1; SMN2
SCHEMBL21653078 0.85 USP7 (0.39) USP7USP47RORCPFKFB2PFKFB1
SCHEMBL21653261 0.82 LRRK2 (0.39) USP7USP47RORCMAPTTP53
SCHEMBL21653277 0.79 AR (0.35) USP7USP47MAPTRXFP1AR
SCHEMBL21653084 0.77 MAPT (0.39) MAPTTP53L3MBTL1PDE10ASMN1; SMN2
SCHEMBL21653251 0.77 GSK3B (0.38) MAPTTP53L3MBTL1RXFP1PDE10A
SCHEMBL21653081 0.76 SMN1; SMN2 (0.38) MAPTTP53RXFP1PDE10ASMN1; SMN2
SCHEMBL21653156 0.76 PDE10A (0.38) MAPTTP53RXFP1PDE10ASMN1; 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
Send feedback