SCHEMBL22207235

SCHEMBL22207235

CC(C)(C)OC(=O)NCC(=O)NC(CCCCN1C(=O)C=CC1=O)C(=O)OC(C)(C)C

nearest known ligand 0.45

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ AKT1 P31749 1/20 0.45
▸ TDP1 Q9NUW8 11/20 0.44
▸ ATM Q13315 2/20 0.44
▸ NPSR1 Q6W5P4 11/20 0.43
▸ KMT2A Q03164 6/20 0.43
▸ POLB P06746 5/20 0.43
▸ MEN1 O00255 5/20 0.43
▸ MAPT P10636 8/20 0.41
▸ KDM4E B2RXH2 5/20 0.38
▸ PAX8 Q06710 2/20 0.38
▸ ALDH1A1 P00352 1/20 0.38
▸ GLA P06280 1/20 0.37
▸ GAA P10253 1/20 0.37

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
SCHEMBL22207234 1.00 AKT1 (0.45) AKT1TDP1ATMNPSR1KMT2A
SCHEMBL23113662 0.91 AKT1 (0.48) AKT1KMT2AMEN1ALDH1A1GAA
SCHEMBL28620433 0.88 AKT1 (0.61) AKT1TDP1NPSR1KMT2AMEN1
SCHEMBL31374732 0.88 AKT1 (0.61) AKT1TDP1NPSR1KMT2AMEN1
SCHEMBL28625037 0.86 CTSS (0.48) AKT1POLBMAPTKDM4EALDH1A1
SCHEMBL28620369 0.85 AKT1 (0.41) AKT1TDP1ATMNPSR1KMT2A
SCHEMBL28624848 0.85 AKT1 (0.41) AKT1TDP1ATMNPSR1KMT2A
SCHEMBL31441165 0.85 AKT1 (0.44) AKT1TDP1ATMNPSR1KMT2A
SCHEMBL28620704 0.85 AKT1 (0.44) AKT1TDP1ATMNPSR1KMT2A
SCHEMBL31374701 0.83 AKT1 (0.37) AKT1TDP1ATMNPSR1KMT2A

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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-113301920-A Complexes comprising ligands, spacers, peptide linkers and biomolecules 安斯泰来制药株式会社 2021-08-24 — — CN disclosed
CN-113271973-A Complex comprising a ligand and a CEACAM5 antibody Fab fragment 安斯泰来制药株式会社 2021-08-17 — — CN disclosed
CN-112135841-A Complexes comprising anti-human MUC1 antibody Fab fragments, peptide linkers, and/or ligands 安斯泰来制药株式会社 2020-12-25 — — CN disclosed
WO-2020145228-A1 COMPLEX COMPRISING LIGAND AND CEACAM5 ANTIBODY FAB FRAGMENT アステラス製薬株式会社 2020-07-16 — — WO disclosed
WO-2020145227-A1 COMPLEX COMPRISING LIGAND, SPACER, PEPTIDE LINKER, AND BIOMOLECULE アステラス製薬株式会社 2020-07-16 — — WO disclosed
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