SCHEMBL31295889

SCHEMBL31295889

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

nearest known ligand 0.61

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ NTSR1 P30989 19/20 0.61
▸ NTSR2 O95665 18/20 0.61
▸ SORT1 Q99523 15/20 0.61

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
SCHEMBL30601855 0.87 OPRM1 (0.50) NTSR1NTSR2SORT1
SCHEMBL30512495 0.86 NTSR1 (0.55) NTSR1NTSR2SORT1
SCHEMBL38660301 0.85 NTSR2 (0.54) NTSR1NTSR2SORT1
SCHEMBL29611815 0.85 NTSR1 (0.51) NTSR1NTSR2SORT1
SCHEMBL30272487 0.84 NTSR1 (0.58) NTSR1NTSR2SORT1
SCHEMBL30512533 0.84 NTSR1 (0.52) NTSR1NTSR2SORT1
SCHEMBL29533517 0.84 NTSR1 (0.82) NTSR1NTSR2SORT1
SCHEMBL30123066 0.84 NTSR2 (0.48) NTSR1NTSR2SORT1
SCHEMBL23639489 0.83 NTSR1 (0.53) NTSR1NTSR2SORT1
SCHEMBL29664292 0.83 XIAP (0.50) NTSR1NTSR2SORT1

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-119119168-A Synthesis method of tyrosine sulfonated polypeptide growth factor 杭州东恒生物医药有限公司 2024-12-13 — — CN disclosed
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