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SCHEMBL29937002

SCHEMBL29937002

CC(C)C[C@H](NC(=O)OCC1c2ccccc2-c2ccccc21)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)O

nearest known ligand 0.56

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ PTPN1 P18031 7/20 0.50
▸ MDM4 O15151 3/20 0.46
▸ TP53 P04637 3/20 0.46
▸ MDM2 Q00987 3/20 0.44

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
SCHEMBL29936762 1.00 PTPN1 (0.50) PTPN1MDM4TP53MDM2
SCHEMBL29936857 1.00 PTPN1 (0.50) PTPN1MDM4TP53MDM2
SCHEMBL29937039 1.00 PTPN1 (0.50) PTPN1MDM4TP53MDM2
SCHEMBL30718996 0.99 PTPN1 (0.49) PTPN1MDM4TP53MDM2
SCHEMBL30241363 0.98 PTPN1 (0.50) PTPN1MDM4TP53MDM2
SCHEMBL30241339 0.97 PTPN1 (0.51) PTPN1
SCHEMBL29937114 0.96 PTPN1 (0.47) PTPN1MDM4TP53MDM2
SCHEMBL29937064 0.96 PTPN1 (0.47) PTPN1MDM4TP53MDM2
SCHEMBL30523593 0.90 MDM4 (0.48) PTPN1MDM4TP53MDM2
SCHEMBL1405816 0.90 MDM4 (0.54) MDM4TP53MDM2

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
CN-115093458-A Acid-activated cell-penetrating polypeptide carrier and application thereof 倪京满 2022-09-23 — — CN disclosed
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