SCHEMBL28124455

SCHEMBL28124455

CC(C)(C)OC(=O)CCCC(N)(C(=O)O)C(=O)OCC1c2ccccc2-c2ccccc21

nearest known ligand 0.42

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 2/20 0.42
FABP5 Q01469 3/20 0.39
FABP7 O15540 2/20 0.39
MDM2 Q00987 1/20 0.37
MDM4 O15151 1/20 0.35
TP53 P04637 1/20 0.35
EPHX2 P34913 1/20 0.35
CA1 P00915 1/20 0.35
CA2 P00918 1/20 0.35
CASP3 P42574 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
SCHEMBL16060617 1.00 KMT2A (0.42) KMT2AFABP5FABP7MDM2MDM4
SCHEMBL28124396 0.97 KMT2A (0.43) KMT2AFABP5FABP7MDM2MDM4
SCHEMBL17079656 0.97 KMT2A (0.43) KMT2AFABP5FABP7MDM2MDM4
SCHEMBL16061106 0.96 KMT2A (0.45) KMT2AFABP5FABP7MDM2MDM4
SCHEMBL28124397 0.96 KMT2A (0.45) KMT2AFABP5FABP7MDM2MDM4
SCHEMBL5973232 0.93 KMT2A (0.41) KMT2AFABP5FABP7MDM2MDM4
SCHEMBL29173690 0.93 KMT2A (0.41) KMT2AFABP5FABP7MDM2MDM4
SCHEMBL16061070 0.89 KMT2A (0.39) KMT2AFABP5FABP7MDM2MDM4
SCHEMBL28035104 0.89 KMT2A (0.39) KMT2AFABP5FABP7MDM2MDM4
SCHEMBL30983360 0.88 KMT2A (0.38) KMT2AFABP5FABP7MDM2MDM4

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-117343142-A Leucine and lysine-rich high-efficiency low-toxicity anti-tumor peptide and application thereof 兰州大学 2024-01-05 CN disclosed
CN-106456574-A Hybrid immunoglobulins containing non-peptide linkages 丹尼尔·J·卡鹏 2017-02-22 CN disclosed