SCHEMBL31385359

SCHEMBL31385359

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

nearest known ligand 0.54

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ MDM4 O15151 2/20 0.49
▸ TP53 P04637 2/20 0.49
▸ CASP3 P42574 2/20 0.47
▸ KMT2A Q03164 2/20 0.47
▸ EPHX2 P34913 1/20 0.45

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
SCHEMBL31385405 0.88 MDM4 (0.47) MDM4TP53CASP3KMT2AEPHX2
SCHEMBL3309050 0.87 MDM4 (0.52) MDM4TP53CASP3KMT2AEPHX2
SCHEMBL29423449 0.87 MDM4 (0.52) MDM4TP53CASP3KMT2AEPHX2
SCHEMBL31370735 0.87 MDM4 (0.52) MDM4TP53CASP3KMT2AEPHX2
SCHEMBL2367138 0.87 MDM4 (0.52) MDM4TP53CASP3KMT2AEPHX2
SCHEMBL29793991 0.87 MDM4 (0.52) MDM4TP53CASP3KMT2AEPHX2
SCHEMBL29738269 0.87 MDM4 (0.50) MDM4TP53CASP3KMT2AEPHX2
SCHEMBL5839367 0.87 KMT2A (0.52) MDM4TP53CASP3KMT2AEPHX2
SCHEMBL7391110 0.87 KMT2A (0.52) MDM4TP53CASP3KMT2AEPHX2
SCHEMBL1486273 0.87 KMT2A (0.52) MDM4TP53CASP3KMT2AEPHX2

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-2025038747-A1 MODIFIED THIOSTREPTON-INSPIRED COMPOUNDS FOR TREATMENT OF CANCER AND PREPARATION THEREOF RS ONCOLOGY, LLC (US) 2025-02-20 — — WO disclosed
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