SCHEMBL24915512

SCHEMBL24915512

CC(=O)CSC[C@H](C)C(=O)N[C@@H](C)C(N)=O

nearest known ligand 0.34

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
ACE P12821 2/20 0.34
METAP2 P50579 3/20 0.32
METAP1 P53582 3/20 0.32
FCER2 P06734 1/20 0.30
CES2 O00748 1/20 0.30

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
SCHEMBL26169813 0.90 FCER2 (0.36) ACEMETAP2METAP1FCER2
SCHEMBL24915444 0.84 ACE (0.35) ACEFCER2
SCHEMBL24916224 0.80 NOD1 (0.34) ACEFCER2
SCHEMBL24916247 0.80 CES2 (0.36) CES2
SCHEMBL24915216 0.77 MME (0.34) METAP1CES2
SCHEMBL24915215 0.76 DPP4 (0.39) METAP2METAP1FCER2
SCHEMBL20910230 0.75 FCER2 (0.35) ACEFCER2
SCHEMBL26857875 0.74 MME (0.33)
SCHEMBL26774841 0.74 MME (0.36) ACECES2
SCHEMBL24713146 0.72 ACE (0.40) ACE

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
WO-2023102507-A1 MACROCYCLIC IMMUNOMODULATORS BRISTOL-MYERS SQUIBB COMPANY (US) 2023-06-08 WO disclosed
WO-2023004240-A1 MACROCYLIC IMMUNOMODULATORS BRISTOL-MYERS SQUIBB COMPANY (US) 2023-01-26 WO disclosed