SCHEMBL25367309

SCHEMBL25367309

CC(C)(C)OC(=O)NCc1ccc(-c2nnc(CCO)nn2)cc1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NAMPT P43490 2/20 0.47
L3MBTL1 Q9Y468 2/20 0.46
HDAC1 Q13547 3/20 0.46
HDAC6 Q9UBN7 1/20 0.45
GRM2 Q14416 1/20 0.43
GAA P10253 1/20 0.42
ATR Q13535 1/20 0.42
SDCBP O00560 1/20 0.41
SDC2 P34741 1/20 0.41
AKT1 P31749 1/20 0.41
MAPT P10636 2/20 0.40
TDP1 Q9NUW8 1/20 0.40
HPN P05981 1/20 0.40
CA1 P00915 1/20 0.40
CA2 P00918 1/20 0.40
RECQL P46063 1/20 0.40
NPSR1 Q6W5P4 1/20 0.40
BRD4 O60885 1/20 0.40
GLS O94925 1/20 0.39
CYP17A1 P05093 1/20 0.39

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
SCHEMBL30392217 0.85 NAMPT (0.43) NAMPTL3MBTL1HDAC1HDAC6GRM2
SCHEMBL15322811 0.85 NAMPT (0.50) NAMPTL3MBTL1HDAC1HDAC6GRM2
SCHEMBL25440112 0.82 NAMPT (0.51) NAMPTL3MBTL1HDAC1HDAC6GAA
SCHEMBL16616006 0.82 NAMPT (0.53) NAMPTL3MBTL1HDAC1HDAC6GRM2
SCHEMBL25440138 0.81 NAMPT (0.47) NAMPTL3MBTL1HDAC1HDAC6GRM2
SCHEMBL26148065 0.81 L3MBTL1 (0.53) NAMPTL3MBTL1HDAC1GAASDCBP
SCHEMBL26054956 0.81 NAMPT (0.47) NAMPTL3MBTL1HDAC1HDAC6GRM2
SCHEMBL28975596 0.81 HDAC1 (0.46) NAMPTL3MBTL1HDAC1HDAC6GRM2
SCHEMBL22746024 0.80 ITGA4 (0.53)
SCHEMBL26328902 0.80 MAPT (0.42) NAMPTL3MBTL1HDAC1AKT1MAPT

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4314031-A1 MASKED IL12 PROTEIN Tagworks Pharmaceuticals B.V. (NL) 2024-02-07 EP disclosed
WO-2023158305-A1 MASKED IL12 PROTEIN TAGWORKS PHARMACEUTICALS B.V. (NL) 2023-08-24 WO disclosed