SCHEMBL30516252

SCHEMBL30516252

CC(C)(C)Oc1ccc(C[C@H](NC(=O)OCC2c3ccccc3-c3ccccc32)C(=O)N[C@@H](Cc2ccc(OC(C)(C)C)cc2)C(=O)N[C@@H](Cc2ccccc2)C(=O)O)cc1

nearest known ligand 0.60

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ PTPN1 P18031 7/20 0.54
▸ CTSL P07711 1/20 0.49
▸ CTSK P43235 1/20 0.49
▸ MDM4 O15151 2/20 0.48
▸ TP53 P04637 2/20 0.48
▸ MDM2 Q00987 1/20 0.47
▸ ITGB3 P05106 2/20 0.47
▸ ITGA2B P08514 2/20 0.47

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
SCHEMBL30516257 1.00 PTPN1 (0.54) PTPN1CTSLCTSKMDM4TP53
SCHEMBL30516235 1.00 PTPN1 (0.54) PTPN1CTSLCTSKMDM4TP53
SCHEMBL30280645 1.00 PTPN1 (0.54) PTPN1CTSLCTSKMDM4TP53
SCHEMBL30516251 1.00 PTPN1 (0.54) PTPN1CTSLCTSKMDM4TP53
SCHEMBL30516240 1.00 PTPN1 (0.54) PTPN1CTSLCTSKMDM4TP53
SCHEMBL30516248 1.00 PTPN1 (0.54) PTPN1CTSLCTSKMDM4TP53
SCHEMBL30516241 1.00 PTPN1 (0.54) PTPN1CTSLCTSKMDM4TP53
SCHEMBL31714182 0.95 MDM4 (0.51) PTPN1CTSLCTSKMDM4TP53
SCHEMBL117946 0.95 MDM4 (0.51) PTPN1CTSLCTSKMDM4TP53
SCHEMBL119588 0.95 MDM4 (0.51) PTPN1CTSLCTSKMDM4TP53

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
US-20230365643-A1 PEPTIDE, AND COSMETIC COMPOSITION AND PHARMACEUTICAL COMPOSITION COMPRISING SAME SEOUL NATIONAL UNIVERSITY HOSPITAL (KR) 2023-11-16 — — US disclosed
EP-4209500-A1 PEPTIDE, AND COSMETIC COMPOSITION AND PHARMACEUTICAL COMPOSITION COMPRISING SAME Seoul National University Hospital (KR) 2023-07-12 — — EP disclosed
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