SCHEMBL30963663

SCHEMBL30963663

CC[C@H](C)[C@H](NC(=O)[C@@H]1CCCN1C(=O)[C@H](CC(=O)O)NC(=O)OCC1c2ccccc2-c2ccccc21)C(=O)O

nearest known ligand 0.49

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ XIAP P98170 1/20 0.49
▸ PRCP P42785 1/20 0.45
▸ CMA1 P23946 2/20 0.43
▸ KMT2A Q03164 1/20 0.42
▸ CASP3 P42574 3/20 0.42
▸ ACE P12821 1/20 0.42
▸ ACE2 Q9BYF1 1/20 0.42
▸ POLB P06746 1/20 0.41
▸ MDM2 Q00987 1/20 0.41
▸ PIN1 Q13526 1/20 0.41
▸ MDM4 O15151 1/20 0.41
▸ TP53 P04637 1/20 0.41
▸ ELANE P08246 3/20 0.40
▸ FDFT1 P37268 1/20 0.40

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
SCHEMBL29706165 0.87 XIAP (0.46) XIAPCMA1KMT2APOLBPIN1
SCHEMBL30963662 0.87 POLB (0.51) XIAPKMT2APOLBELANE
SCHEMBL30057736 0.85 PRCP (0.49) PRCPKMT2ACASP3ACEACE2
SCHEMBL29350646 0.84 POLB (0.48) XIAPKMT2APOLBELANE
SCHEMBL15216177 0.84 POLB (0.48) XIAPKMT2APOLBELANE
SCHEMBL22804000 0.84 POLB (0.48) XIAPKMT2APOLBELANE
SCHEMBL20210374 0.84 POLB (0.48) XIAPKMT2APOLBELANE
SCHEMBL10512329 0.83 KMT2A (0.53) PRCPKMT2ACASP3ACEACE2
SCHEMBL29400819 0.83 KMT2A (0.53) PRCPKMT2ACASP3ACEACE2
SCHEMBL30744273 0.82 PRCP (0.47) PRCPKMT2ACASP3ACEACE2

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-4631955-A1 PURIFICATION METHOD AND PRODUCTION METHOD OF CYCLIC PEPTIDE CHUGAI SEIYAKU KABUSHIKI KAISHA (JP) 2025-10-15 — — EP disclosed
WO-2024143514-A1 PURIFICATION METHOD AND PRODUCTION METHOD OF CYCLIC PEPTIDE 中外製薬株式会社 2024-07-04 — — WO disclosed
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