SCHEMBL30569809

SCHEMBL30569809

CCC(=O)NCC(=O)N[C@H](C(=O)N[C@@H](C)C(=O)O)C(C)C

nearest known ligand 0.44

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
PSMB5 P28074 1/20 0.44
MME P08473 1/20 0.41
ACE P12821 1/20 0.41
CPA1 P15085 1/20 0.41
ACE2 Q9BYF1 1/20 0.41
SMN1; SMN2 Q16637 2/20 0.36
LTA4H P09960 3/20 0.35
FAAH O00519 2/20 0.35
SLC6A5 Q9Y345 1/20 0.35

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
SCHEMBL31303692 0.98 PSMB5 (0.43) PSMB5MMEACECPA1ACE2
SCHEMBL24191292 0.86 MME (0.37) MMEACECPA1ACE2LTA4H
SCHEMBL23894144 0.85 PSMB5 (0.53) PSMB5MMEACECPA1ACE2
SCHEMBL30569794 0.83 PSMB5 (0.49) PSMB5SMN1; SMN2
SCHEMBL34464920 0.82 OPRD1 (0.38) MMEACECPA1ACE2
SCHEMBL2555309 0.82 MME (0.43) MMEACECPA1ACE2LTA4H
SCHEMBL2555307 0.82 MME (0.43) MMEACECPA1ACE2LTA4H
SCHEMBL29387536 0.81 MME (0.43) MMEACECPA1ACE2
SCHEMBL23629908 0.80 CTSS (0.51)
SCHEMBL23629905 0.80 CTSS (0.51)

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-117069793-A Bifunctional linker compound, antibody drug conjugate, and preparation methods and applications thereof 杭州爱科瑞思生物医药有限公司 2023-11-17 CN disclosed
CN-116712561-A Antibody-drug conjugates containing an N-methyleneamide linker 杭州爱科瑞思生物医药有限公司 2023-09-08 CN disclosed