SCHEMBL23626437

SCHEMBL23626437

CN(C)[C@H](CO)CNC(=O)OC(C)(C)C

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 1/20 0.49
GAA P10253 2/20 0.42
MEN1 O00255 1/20 0.42
KMT2A Q03164 1/20 0.42
SYK P43405 1/20 0.37
SERPINE1 P05121 1/20 0.37
CA1 P00915 3/20 0.37
CA7 P43166 2/20 0.37
CA2 P00918 2/20 0.37
MAOA P21397 1/20 0.36
MAOB P27338 1/20 0.36
CTSS P25774 3/20 0.36
CTSK P43235 3/20 0.36
CTSL P07711 1/20 0.36
CTSB P07858 1/20 0.36
MALT1 Q9UDY8 1/20 0.36
KDM4E B2RXH2 1/20 0.35
LMNA P02545 1/20 0.35
CA12 O43570 2/20 0.35
CA14 Q9ULX7 1/20 0.35

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
SCHEMBL6675377 0.80 TDP1 (0.58) TDP1GAAMEN1KMT2ACA1
SCHEMBL4616160 0.80 MEN1 (0.41) TDP1GAAMEN1KMT2ASYK
SCHEMBL34474705 0.79 MEN1 (0.45) TDP1GAAMEN1KMT2ASYK
SCHEMBL25859878 0.79 MEN1 (0.45) TDP1GAAMEN1KMT2ASYK
SCHEMBL17860156 0.78 TDP1 (0.50) TDP1GAAMEN1KMT2ASYK
SCHEMBL7518298 0.78 TDP1 (0.50) TDP1GAAMEN1KMT2ASYK
SCHEMBL31038364 0.77 TDP1 (0.42) TDP1GAAMEN1KMT2ASYK
SCHEMBL1222350 0.77 TDP1 (0.49) TDP1GAAMEN1KMT2ASYK
SCHEMBL1222348 0.77 TDP1 (0.49) TDP1GAAMEN1KMT2ASYK
SCHEMBL4269209 0.77 TDP1 (0.49) TDP1GAAMEN1KMT2ASYK

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-2021136808-A1 CONJUGATES UNDERGOING INTRAMOLECULAR REARRANGEMENTS ASCENDIS PHARMA A/S (DK) 2021-07-08 WO disclosed