SCHEMBL29801770

SCHEMBL29801770

C[C@H](NC(=O)[C@@H]1CCCN1C(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](N)CCC(N)=O)C(=O)N[C@@H](CCCCN)C(=O)O

nearest known ligand 0.48

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ OPRM1 P35372 9/20 0.48
▸ OPRK1 P41145 9/20 0.48
▸ NRP1 O14786 2/20 0.47
▸ NTSR2 O95665 2/20 0.45
▸ NTSR1 P30989 2/20 0.45
▸ CXCR4 P61073 1/20 0.44
▸ APLNR P35414 1/20 0.44
▸ F2 P00734 1/20 0.44

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
SCHEMBL30689127 0.98 OPRM1 (0.50) OPRM1OPRK1NRP1CXCR4APLNR
SCHEMBL31034440 0.92 NRP1 (0.44) OPRM1OPRK1NRP1
SCHEMBL29535207 0.91 OPRM1 (0.52) OPRM1OPRK1NRP1CXCR4APLNR
SCHEMBL29801896 0.91 NRP1 (0.42) OPRM1OPRK1NRP1
SCHEMBL30855542 0.91 NRP1 (0.49) OPRM1OPRK1NRP1NTSR2NTSR1
SCHEMBL31399622 0.91 NRP1 (0.49) OPRM1OPRK1NRP1NTSR2NTSR1
SCHEMBL29571627 0.91 NRP1 (0.54) OPRM1OPRK1NRP1NTSR2NTSR1
SCHEMBL30307576 0.91 NRP1 (0.47) OPRM1NRP1F2
SCHEMBL29801769 0.90 OPRM1 (0.49) OPRM1OPRK1CXCR4APLNR
SCHEMBL29872595 0.90 NRP1 (0.54) OPRM1OPRK1NRP1NTSR2NTSR1

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 9 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
CN-112175041-B Ethyl QRPAK modified bis-carbolino piperazine diketone and preparation, activity and application thereof 首都医科大学(CN) 2023-01-13 — — CN 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
CN-118459544-A PAK sequence peptide modified diindolylmethane derivative and preparation and application thereof 首都医科大学 2024-08-09 — — CN disclosed
EP-4306534-A1 MULTIFUNCTIONAL POLYPEPTIDE AND APPLICATION THEREOF IN FIELD OF MEDICINES Wuhan Innerse Pharmaceutical Inc. (CN) 2024-01-17 — — EP disclosed
US-20230312644-A1 COMPOUNDS HAVING TRIPLE ACTIVITIES OF THROMBOLYSIS, ANTITHROMBOTIC AND RADICAL SCAVENGING SHANGHAI LUMOSA THERAPEUTICS CO LTD (CN) 2023-10-05 — — US disclosed
CN-112175041-B Ethyl QRPAK modified bis-carbolino piperazine diketone and preparation, activity and application thereof 首都医科大学(CN) 2023-01-13 — — CN disclosed
CN-112175041-B Ethyl QRPAK modified bis-carbolino piperazine diketone and preparation, activity and application thereof 首都医科大学(CN) 2023-01-13 — — CN 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

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20230312644-A1 COMPOUNDS HAVING TRIPLE ACTIVITIES OF THROMBOLYSIS, ANTITHROMBOTIC AND RADICAL SCAVENGING SERPINC1, PLAT, F2 OPRM1 3249/4885OPRK1 2963/4885NRP1 2622/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.

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