SCHEMBL31741306

SCHEMBL31741306

C[C@@H](O)[C@H](N)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CC(N)=O)C(=O)O

nearest known ligand 0.49

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ GRB2 P62993 1/20 0.49
▸ SLC6A2 P23975 1/20 0.43
▸ ACE P12821 2/20 0.43
▸ REN P00797 1/20 0.43
▸ NMUR2 Q9GZQ4 2/20 0.43
▸ NPY1R P25929 1/20 0.41
▸ XIAP P98170 1/20 0.41
▸ CAPN1 P07384 2/20 0.41
▸ CTSD P07339 1/20 0.41
▸ BACE1 P56817 1/20 0.41
▸ CALCRL Q16602 1/20 0.41
▸ NMUR1 Q9HB89 1/20 0.40
▸ CMA1 P23946 1/20 0.40
▸ STAT3 P40763 1/20 0.40
▸ KEAP1 Q14145 1/20 0.40
▸ NTSR2 O95665 1/20 0.39
▸ NTSR1 P30989 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
SCHEMBL30118985 0.90 GRB2 (0.48) GRB2ACENMUR2NPY1RNTSR2
SCHEMBL30435105 0.88 OPRM1 (0.46) GRB2ACERENNMUR2
SCHEMBL29531054 0.88 SLC6A2 (0.47) GRB2SLC6A2ACERENXIAP
SCHEMBL30974457 0.87 GRB2 (0.52) GRB2SLC6A2ACERENNTSR2
SCHEMBL29377895 0.86 GRB2 (0.50) GRB2ACERENNMUR2NPY1R
SCHEMBL31412203 0.85 GRB2 (0.46) GRB2XIAPCAPN1CTSDBACE1
SCHEMBL29379577 0.85 GRB2 (0.50) GRB2ACERENNMUR2NPY1R
SCHEMBL30434514 0.85 F2 (0.45) GRB2XIAP
SCHEMBL30596292 0.85 OPRM1 (0.48) GRB2ACERENXIAP
SCHEMBL30435342 0.84 OPRM1 (0.44) GRB2SLC6A2ACERENNMUR2

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
CN-121086010-A STPEN novel polypeptide and application thereof in cardiovascular improvement medicines 浙江国本医药集团有限公司 2025-12-09 — — CN disclosed
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