SCHEMBL30496008

SCHEMBL30496008

CC(C)(C)OC(=O)NCCCCC(C[C@H]1CC(=O)NC1=O)NC(=O)OC(C)(C)C

nearest known ligand 0.42

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 8/20 0.42
KMT2A Q03164 8/20 0.42
GAA P10253 1/20 0.42
TDP1 Q9NUW8 5/20 0.41
ATM Q13315 2/20 0.40
POLB P06746 2/20 0.39
NPSR1 Q6W5P4 2/20 0.39
HDAC1 Q13547 1/20 0.39
HDAC8 Q9BY41 1/20 0.39
MAOA P21397 1/20 0.38
MAOB P27338 1/20 0.38
MAPT P10636 2/20 0.37
CA12 O43570 1/20 0.36
CA1 P00915 1/20 0.36
CA2 P00918 1/20 0.36
CA9 Q16790 1/20 0.36
DDB1 Q16531 1/20 0.36
CRBN Q96SW2 1/20 0.36
ALDH1A1 P00352 1/20 0.36

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
SCHEMBL28799343 0.78 TDP1 (0.44) MEN1KMT2AGAATDP1ATM
SCHEMBL9315139 0.76 IDO1 (0.45) GAAHDAC1DDB1CRBN
SCHEMBL31644558 0.75 IDO1 (0.43) GAAHDAC1DDB1CRBN
SCHEMBL10190369 0.74 TDP1 (0.59) MEN1KMT2AGAATDP1ATM
SCHEMBL20358461 0.74 MEN1 (0.56) MEN1KMT2AGAATDP1ATM
SCHEMBL23168272 0.74 TDP1 (0.59) MEN1KMT2AGAATDP1ATM
SCHEMBL8062203 0.74 TDP1 (0.59) MEN1KMT2AGAATDP1ATM
SCHEMBL12386373 0.74 MEN1 (0.45) MEN1KMT2AGAATDP1ATM
SCHEMBL13767609 0.73 MEN1 (0.55) MEN1KMT2AGAATDP1ATM
SCHEMBL22162664 0.73 MEN1 (0.55) MEN1KMT2AGAATDP1ATM

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
CN-114805477-B Synthesis method of L-lysyl-L-tyrosine 武汉桀升生物科技有限公司 2023-07-18 CN claimed
CN-114805477-B Synthesis method of L-lysyl-L-tyrosine 武汉桀升生物科技有限公司 2023-07-18 CN disclosed