SCHEMBL28620369

SCHEMBL28620369

CC(C)(C)OC(=O)[C@H](CCCCN1C(=O)C=CC1=O)NC(=O)CN

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ AKT1 P31749 1/20 0.41
▸ TDP1 Q9NUW8 4/20 0.37
▸ ATM Q13315 2/20 0.37
▸ MGLL Q99685 4/20 0.37
▸ FAAH O00519 3/20 0.37
▸ NPSR1 Q6W5P4 3/20 0.36
▸ MAPT P10636 2/20 0.36
▸ HSP90AA1 P07900 1/20 0.36
▸ TLR9 Q9NR96 1/20 0.36
▸ ALDH1A1 P00352 1/20 0.36
▸ LMNA P02545 1/20 0.36
▸ TP53 P04637 1/20 0.36
▸ PKM P14618 1/20 0.36
▸ HPGD P15428 1/20 0.36
▸ XBP1 P17861 1/20 0.36
▸ MAPK1 P28482 1/20 0.36
▸ HTT P42858 1/20 0.36
▸ RECQL P46063 1/20 0.36
▸ RAB9A P51151 1/20 0.36
▸ SMN1; SMN2 Q16637 1/20 0.36

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
SCHEMBL28624848 1.00 AKT1 (0.41) AKT1TDP1ATMMGLLFAAH
Trifluoroacetic Acid SCHEMBL22207652 0.94 AKT1 (0.43) AKT1TDP1ATMNPSR1MAPT
Trifluoroacetic Acid SCHEMBL22207651 0.94 AKT1 (0.43) AKT1TDP1ATMNPSR1MAPT
SCHEMBL28922741 0.88 AKT1 (0.56) AKT1TDP1SSTR2SSTR1SSTR4
SCHEMBL28922739 0.88 AKT1 (0.56) AKT1TDP1SSTR2SSTR1SSTR4
SCHEMBL22207235 0.85 AKT1 (0.45) AKT1TDP1ATMNPSR1MAPT
SCHEMBL22207234 0.85 AKT1 (0.45) AKT1TDP1ATMNPSR1MAPT
SCHEMBL18272971 0.84 SSTR2 (0.40) AKT1TDP1ATMNPSR1MEN1
SCHEMBL22134524 0.84 SSTR2 (0.40) AKT1TDP1ATMNPSR1MEN1
SCHEMBL31374701 0.82 AKT1 (0.37) AKT1TDP1ATMMGLLFAAH

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-113301920-B Complexes comprising a ligand, a spacer, a peptide linker and a biomolecule 安斯泰来制药株式会社 2025-01-14 — — CN disclosed
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
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