SCHEMBL28625037

SCHEMBL28625037

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

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CTSS P25774 2/20 0.48
▸ CTSK P43235 2/20 0.48
▸ AKT1 P31749 1/20 0.47
▸ CA2 P00918 1/20 0.44
▸ EPHX2 P34913 1/20 0.41
▸ KDM4E B2RXH2 5/20 0.39
▸ ALDH1A1 P00352 4/20 0.39
▸ HPGD P15428 2/20 0.39
▸ LMNA P02545 1/20 0.39
▸ THRB P10828 1/20 0.39
▸ KLK7 P49862 1/20 0.39
▸ KLK5 Q9Y337 1/20 0.38
▸ F10 P00742 1/20 0.38
▸ MAPT P10636 2/20 0.37
▸ NPC1 O15118 1/20 0.37
▸ PLIN1 O60240 1/20 0.37
▸ RAB9A P51151 1/20 0.37
▸ PLIN5 Q00G26 1/20 0.37
▸ SMN1; SMN2 Q16637 1/20 0.37
▸ ABHD5 Q8WTS1 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 0.86 AKT1 (0.45) AKT1KDM4EALDH1A1MAPTPOLB
SCHEMBL22207235 0.86 AKT1 (0.45) AKT1KDM4EALDH1A1MAPTPOLB
SCHEMBL22207315 0.86 FNTA (0.50) AKT1CA2KDM4EMAPTPOLB
SCHEMBL22207314 0.86 FNTA (0.50) AKT1CA2KDM4EMAPTPOLB
SCHEMBL28619772 0.84 FNTA (0.46) AKT1CA2F10
SCHEMBL18942764 0.79 AKT1 (0.52) CTSSCTSKAKT1ALDH1A1HPGD
SCHEMBL29309809 0.78 AKT1 (0.69) CTSSCTSKAKT1
SCHEMBL22297607 0.78 BACE1 (0.48) CTSSCTSKAKT1BACE1
SCHEMBL23113662 0.78 AKT1 (0.48) CTSSCTSKAKT1ALDH1A1HDAC4
SCHEMBL29460392 0.78 KLK7 (0.56) CTSSCTSKKLK7KLK5MAPT

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
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
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