SCHEMBL29801935

SCHEMBL29801935

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

nearest known ligand 0.44

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ OPRK1 P41145 10/20 0.44
▸ OPRM1 P35372 9/20 0.44
▸ ACE P12821 3/20 0.43
▸ MC4R P32245 1/20 0.40
▸ F11 P03951 1/20 0.40

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
SCHEMBL29801769 0.95 OPRM1 (0.49) OPRK1OPRM1ACEMC4R
SCHEMBL29802056 0.95 OPRK1 (0.46) OPRK1OPRM1ACE
SCHEMBL30471842 0.93 ACE (0.41) OPRK1OPRM1ACE
SCHEMBL29801999 0.91 OPRM1 (0.48) OPRK1OPRM1ACE
SCHEMBL31039948 0.90 CXCR4 (0.47) OPRK1OPRM1ACE
SCHEMBL29801687 0.89 OPRM1 (0.47) OPRK1OPRM1ACE
SCHEMBL29802045 0.89 OPRK1 (0.49) OPRK1OPRM1ACE
SCHEMBL30422984 0.88 ACE (0.47) OPRK1OPRM1ACE
SCHEMBL30173901 0.87 ACE (0.44) OPRK1OPRM1ACE
SCHEMBL30909432 0.87 OPRK1 (0.53) OPRK1OPRM1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4306534-A1 MULTIFUNCTIONAL POLYPEPTIDE AND APPLICATION THEREOF IN FIELD OF MEDICINES Wuhan Innerse Pharmaceutical Inc. (CN) 2024-01-17 — — EP claimed
WO-2022188878-A1 MULTIFUNCTIONAL POLYPEPTIDE AND APPLICATION THEREOF IN FIELD OF MEDICINES 武汉英纳氏药业有限公司 2022-09-15 — — WO claimed
EP-4306534-A1 MULTIFUNCTIONAL POLYPEPTIDE AND APPLICATION THEREOF IN FIELD OF MEDICINES Wuhan Innerse Pharmaceutical Inc. (CN) 2024-01-17 — — EP disclosed
WO-2022188878-A1 MULTIFUNCTIONAL POLYPEPTIDE AND APPLICATION THEREOF IN FIELD OF MEDICINES 武汉英纳氏药业有限公司 2022-09-15 — — WO disclosed
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