SCHEMBL24580465

SCHEMBL24580465

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

nearest known ligand 0.45

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ KMT2A Q03164 2/20 0.40
▸ FABP5 Q01469 3/20 0.36
▸ CTSL P07711 1/20 0.36
▸ CTSB P07858 1/20 0.36
▸ CTSS P25774 1/20 0.36
▸ CTSK P43235 1/20 0.36
▸ EPHX2 P34913 1/20 0.36
▸ CASP3 P42574 3/20 0.35
▸ FABP7 O15540 2/20 0.35
▸ PTPN1 P18031 1/20 0.33

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
SCHEMBL29696614 0.91 KMT2A (0.38) KMT2AFABP5CTSLCTSBCTSS
SCHEMBL26605892 0.91 KMT2A (0.38) KMT2AFABP5CTSLCTSBCTSS
SCHEMBL24579341 0.91 KMT2A (0.38) KMT2AFABP5CTSLCTSBCTSS
SCHEMBL24579340 0.91 KMT2A (0.38) KMT2AFABP5CTSLCTSBCTSS
SCHEMBL29697697 0.91 KMT2A (0.38) KMT2AFABP5CTSLCTSBCTSS
SCHEMBL24579145 0.88 KMT2A (0.35) KMT2AFABP5CTSLCTSBCTSS
SCHEMBL30861942 0.88 KMT2A (0.35) KMT2AFABP5CTSLCTSBCTSS
SCHEMBL24579143 0.88 KMT2A (0.35) KMT2AFABP5CTSLCTSBCTSS
SCHEMBL29696607 0.87 KMT2A (0.34) KMT2AFABP5CTSLCTSBCTSS
SCHEMBL30517401 0.84 KMT2A (0.40) KMT2AFABP5CTSLCTSBCTSS

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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