SCHEMBL24946398

SCHEMBL24946398

CC(C)(C)OC(=O)NCc1ccc(CC(C(O)O)N(CC(=O)O)CC(=O)O)cc1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 2/20 0.43
HDAC1 Q13547 1/20 0.43
ATM Q13315 1/20 0.43
MEN1 O00255 1/20 0.42
KMT2A Q03164 1/20 0.42
NAMPT P43490 2/20 0.42
GAA P10253 1/20 0.41
SDCBP O00560 1/20 0.41
SDC2 P34741 1/20 0.41
CTSS P25774 6/20 0.40
CTSK P43235 5/20 0.40
MAPT P10636 2/20 0.40
KDM4E B2RXH2 1/20 0.40
TDP1 Q9NUW8 1/20 0.40
RECQL P46063 1/20 0.39
NPSR1 Q6W5P4 1/20 0.39
CA1 P00915 1/20 0.39
CA2 P00918 1/20 0.39
CTSL P07711 1/20 0.39
CTSB P07858 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
SCHEMBL24946291 0.84 L3MBTL1 (0.44) L3MBTL1HDAC1ATMMEN1KMT2A
SCHEMBL21533322 0.78 L3MBTL1 (0.49) L3MBTL1HDAC1ATMMEN1KMT2A
SCHEMBL3180689 0.77 L3MBTL1 (0.61) L3MBTL1HDAC1NAMPTGAASDCBP
SCHEMBL38655668 0.76 L3MBTL1 (0.52) L3MBTL1HDAC1ATMMEN1KMT2A
SCHEMBL10441345 0.76 SDCBP (0.54) L3MBTL1HDAC1ATMMEN1KMT2A
SCHEMBL1852791 0.75 EPHX2 (0.58) L3MBTL1HDAC1NAMPTGAASDCBP
SCHEMBL1244728 0.75 EPHX2 (0.56) L3MBTL1HDAC1ATMMEN1KMT2A
SCHEMBL12463672 0.75 SLC7A5 (0.52) L3MBTL1HDAC1ATMMEN1KMT2A
SCHEMBL20038756 0.75 SLC7A5 (0.52) L3MBTL1HDAC1ATMMEN1KMT2A
SCHEMBL12463287 0.75 SLC7A5 (0.52) L3MBTL1HDAC1ATMMEN1KMT2A

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-2023002452-A1 PROCESS FOR PREPARATION OF TARGETING LIGANDS Janssen Pharmaceuticals, Inc. (US) 2023-01-26 WO disclosed