SCHEMBL31382767

SCHEMBL31382767

CC(C)(C)OC(=O)n1cnc(C[C@H](NC(=O)OCC2c3ccccc3-c3ccccc32)C(=O)NC(C)(C)C(=O)O)c1

nearest known ligand 0.49

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ MDM4 O15151 2/20 0.45
▸ TP53 P04637 2/20 0.45
▸ MDM2 Q00987 3/20 0.44
▸ BACE1 P56817 1/20 0.43
▸ CASP3 P42574 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
SCHEMBL31494731 0.95 MDM4 (0.47) MDM4TP53MDM2CASP3
SCHEMBL3439705 0.91 MDM4 (0.52) MDM4TP53MDM2
SCHEMBL21474286 0.91 MDM4 (0.52) MDM4TP53MDM2
SCHEMBL13697504 0.91 MDM4 (0.52) MDM4TP53MDM2
SCHEMBL29400729 0.91 MDM4 (0.52) MDM4TP53MDM2
SCHEMBL29386828 0.91 MDM4 (0.52) MDM4TP53MDM2
SCHEMBL31382825 0.90 MDM4 (0.46) MDM4TP53MDM2BACE1
SCHEMBL10074077 0.85 CASP3 (0.44) MDM4TP53MDM2BACE1CASP3
SCHEMBL30385679 0.85 MDM4 (0.49) MDM4TP53MDM2
SCHEMBL23373989 0.84 MDM4 (0.42) MDM4TP53MDM2BACE1CASP3

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
EP-3728304-B1 SOLID PHASE SYNTHESIS OF ACYLATED PEPTIDES BACHEM HOLDING AG (CH) 2025-02-12 — — EP disclosed
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