SCHEMBL31189249

SCHEMBL31189249

CC(C)(C)OC(=O)Cn1cc(CC(NC(=O)OCC2c3ccccc3-c3ccccc32)C(=O)O)c2cnccc21

nearest known ligand 0.50

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ MDM4 O15151 3/20 0.46
▸ TP53 P04637 3/20 0.46
▸ MDM2 Q00987 7/20 0.46
▸ SLC17A5 Q9NRA2 1/20 0.40
▸ CASP3 P42574 1/20 0.38

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
SCHEMBL19410224 1.00 MDM4 (0.46) MDM4TP53MDM2SLC17A5CASP3
SCHEMBL32664869 0.91 MDM4 (0.48) MDM4TP53MDM2SLC17A5CASP3
SCHEMBL30002165 0.91 MDM4 (0.48) MDM4TP53MDM2SLC17A5CASP3
SCHEMBL30959635 0.91 MDM4 (0.48) MDM4TP53MDM2SLC17A5CASP3
SCHEMBL16100700 0.91 MDM4 (0.48) MDM4TP53MDM2SLC17A5CASP3
SCHEMBL16100697 0.91 MDM4 (0.48) MDM4TP53MDM2SLC17A5CASP3
SCHEMBL25356586 0.88 MDM4 (0.48) MDM4TP53MDM2SLC17A5CASP3
SCHEMBL31370257 0.88 MDM4 (0.48) MDM4TP53MDM2SLC17A5CASP3
SCHEMBL25356592 0.88 MDM4 (0.48) MDM4TP53MDM2SLC17A5CASP3
SCHEMBL19410153 0.87 MDM4 (0.46) MDM4TP53MDM2SLC17A5CASP3

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-3440097-B1 MACROCYCLIC INHIBITORS OF THE PD-1/PD-L1 AND CD80/PD-L1 PROTEIN/PROTEIN INTERACTIONS BRISTOL MYERS SQUIBB CO (US) 2024-10-23 — — EP disclosed
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