SCHEMBL24580492

SCHEMBL24580492

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

nearest known ligand 0.54

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ CASP3 P42574 3/20 0.48
▸ MDM4 O15151 2/20 0.47
▸ TP53 P04637 2/20 0.47
▸ KMT2A Q03164 1/20 0.47
▸ TLR2 O60603 2/20 0.46

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
SCHEMBL29696629 1.00 CASP3 (0.48) CASP3MDM4TP53KMT2ATLR2
SCHEMBL30640807 1.00 CASP3 (0.48) CASP3MDM4TP53KMT2ATLR2
SCHEMBL31506328 0.98 KMT2A (0.47) CASP3MDM4TP53KMT2ATLR2
SCHEMBL8140875 0.89 CASP3 (0.51) CASP3MDM4TP53KMT2ATLR2
SCHEMBL29696728 0.89 MDM4 (0.47) CASP3MDM4TP53TLR2
SCHEMBL30562127 0.88 MDM4 (0.53) CASP3MDM4TP53TLR2
SCHEMBL119565 0.87 MDM4 (0.56) CASP3MDM4TP53TLR2
SCHEMBL598209 0.87 MDM4 (0.56) CASP3MDM4TP53TLR2
SCHEMBL119575 0.87 MDM4 (0.56) CASP3MDM4TP53TLR2
SCHEMBL30802551 0.87 MDM4 (0.56) CASP3MDM4TP53TLR2

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
EP-4269422-A1 METHOD FOR PRODUCING PEPTIDE COMPOUND CONTAINING N-SUBSTITUTED-AMINO ACID RESIDUE CHUGAI SEIYAKU KABUSHIKI KAISHA (JP) 2023-11-01 — — EP disclosed
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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