SCHEMBL31369287

SCHEMBL31369287

CC(C)C[C@H](NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCCCN)NC(=O)[C@@H](NC(=O)[C@@H](N)[C@@H](C)O)[C@@H](C)O)C(=O)N[C@@H](CCCCN)C(N)=O

nearest known ligand 0.44

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
GRIN2D O15399 1/20 0.44
GRIN3B O60391 1/20 0.44
GRIN1 Q05586 1/20 0.44
GRIN2A Q12879 1/20 0.44
GRIN2B Q13224 1/20 0.44
GRIN2C Q14957 1/20 0.44
GRIN3A Q8TCU5 1/20 0.44
FURIN P09958 1/20 0.44
PCSK6 P29122 1/20 0.44
KISS1R Q969F8 7/20 0.43
ERAP2 Q6P179 1/20 0.39
ERAP1 Q9NZ08 1/20 0.39
LNPEP Q9UIQ6 1/20 0.39
CTSD P07339 1/20 0.39
BACE1 P56817 1/20 0.39

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
SCHEMBL31369329 0.95 ERAP2 (0.42) GRIN2DGRIN3BGRIN1GRIN2AGRIN2B
SCHEMBL31181199 0.88 ERAP2 (0.46) FURINPCSK6ERAP2ERAP1LNPEP
SCHEMBL30973959 0.86 FOLH1 (0.43) CTSDBACE1
SCHEMBL29611954 0.85 FURIN (0.49) GRIN2DGRIN3BGRIN1GRIN2AGRIN2B
SCHEMBL31369318 0.84 GRIN2D (0.56) GRIN2DGRIN3BGRIN1GRIN2AGRIN2B
SCHEMBL31027962 0.83 NMT2 (0.43) GRIN2DGRIN3BGRIN1GRIN2AGRIN2B
SCHEMBL30974344 0.83 BACE1 (0.50) GRIN2DGRIN3BGRIN1GRIN2AGRIN2B
SCHEMBL30851381 0.83 BACE1 (0.51) CTSDBACE1
SCHEMBL30436298 0.83 FURIN (0.52) GRIN2DGRIN3BGRIN1GRIN2AGRIN2B
SCHEMBL31369334 0.82 NPY4R (0.48) GRIN2DGRIN3BGRIN1GRIN2AGRIN2B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2025058511-A1 ACYLTRANSFERASE-CATALYSED MODIFICATION OF PEPTIDES ENDOPROTEASE SERVICES B.V. (NL) 2025-03-20 WO disclosed