SCHEMBL24579265

SCHEMBL24579265

CC(C)[C@@H](C(=O)NCC(=O)O)N(C)C(=O)OCC1c2ccccc2-c2ccccc21

nearest known ligand 0.45

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ KMT2A Q03164 2/20 0.45
▸ CASP3 P42574 4/20 0.42
▸ FABP5 Q01469 3/20 0.39
▸ FABP7 O15540 2/20 0.39
▸ EPHX2 P34913 1/20 0.38

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
SCHEMBL24579350 1.00 KMT2A (0.45) KMT2ACASP3FABP5FABP7EPHX2
SCHEMBL30640770 1.00 KMT2A (0.45) KMT2ACASP3FABP5FABP7EPHX2
SCHEMBL29696682 1.00 KMT2A (0.45) KMT2ACASP3FABP5FABP7EPHX2
SCHEMBL24580350 0.90 KMT2A (0.44) KMT2ACASP3FABP5FABP7EPHX2
SCHEMBL29696733 0.87 KMT2A (0.40) KMT2ACASP3FABP5FABP7EPHX2
SCHEMBL24579261 0.85 KMT2A (0.40) KMT2ACASP3FABP5FABP7EPHX2
SCHEMBL24580454 0.85 KMT2A (0.40) KMT2ACASP3FABP5FABP7EPHX2
SCHEMBL118228 0.85 KMT2A (0.45) KMT2ACASP3FABP5FABP7EPHX2
SCHEMBL119544 0.85 KMT2A (0.45) KMT2ACASP3FABP5FABP7EPHX2
SCHEMBL29400735 0.85 KMT2A (0.45) KMT2ACASP3FABP5FABP7EPHX2

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-2022138891-A1 METHOD FOR PRODUCING PEPTIDE COMPOUND CONTAINING N-SUBSTITUTED-AMINO ACID RESIDUE 中外製薬株式会社 2022-06-30 — — WO disclosed
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