SCHEMBL30239685

SCHEMBL30239685

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

nearest known ligand 0.47

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
XIAP P98170 1/20 0.47
NTSR1 P30989 9/20 0.45
NTSR2 O95665 7/20 0.45
SORT1 Q99523 3/20 0.45
GRB2 P62993 1/20 0.44
F2 P00734 1/20 0.44
REN P00797 4/20 0.43
NPY1R P25929 1/20 0.43

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
SCHEMBL30239262 0.90 NTSR1 (0.48) XIAPNTSR1NTSR2SORT1REN
SCHEMBL31433252 0.87 GRB2 (0.50) NTSR1NTSR2SORT1GRB2F2
SCHEMBL30052876 0.87 XIAP (0.53) XIAPGRB2
SCHEMBL30599189 0.87 XIAP (0.53) XIAPNTSR1NTSR2SORT1GRB2
SCHEMBL31058052 0.86 OPRM1 (0.47) XIAPNTSR1NTSR2SORT1GRB2
SCHEMBL31433238 0.86 GRB2 (0.51) XIAPNTSR1NTSR2SORT1GRB2
SCHEMBL31516394 0.85 OPRM1 (0.46) XIAPNTSR1NTSR2SORT1GRB2
SCHEMBL30052522 0.85 ACE (0.45) XIAPF2REN
SCHEMBL31665898 0.85 DPP3 (0.52) XIAPREN
SCHEMBL30320536 0.84 OPRM1 (0.49) NTSR1NTSR2GRB2F2

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-115785215-A Mussel peptide and preparation method and application thereof 青岛琛蓝生物科技有限公司 2023-03-14 CN disclosed