SCHEMBL29802012

SCHEMBL29802012

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

nearest known ligand 0.48

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
ACE P12821 3/20 0.48
NTSR2 O95665 6/20 0.47
NTSR1 P30989 6/20 0.47
F2 P00734 1/20 0.47
GRB2 P62993 1/20 0.46
NRP1 O14786 1/20 0.45
XIAP P98170 1/20 0.45
OPRM1 P35372 1/20 0.44
APLNR P35414 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
SCHEMBL29801717 0.96 GRB2 (0.51) ACENTSR2NTSR1F2GRB2
SCHEMBL29571867 0.95 F2 (0.46) ACENTSR2NTSR1F2GRB2
SCHEMBL29801939 0.95 ACE (0.50) ACENTSR2NTSR1F2GRB2
SCHEMBL29802097 0.94 ACE (0.50) ACENTSR2NTSR1OPRM1APLNR
SCHEMBL29802139 0.94 F2 (0.49) ACENTSR2NTSR1F2GRB2
SCHEMBL29801996 0.94 ACE (0.47) ACENTSR2NTSR1F2GRB2
SCHEMBL29445609 0.92 F2 (0.57) NTSR2NTSR1F2GRB2NRP1
SCHEMBL29802257 0.91 NRP1 (0.53) ACENTSR2NTSR1F2GRB2
SCHEMBL29802028 0.90 GRB2 (0.48) ACENTSR2NTSR1F2GRB2
SCHEMBL29802048 0.90 GRB2 (0.52) ACENTSR2NTSR1F2GRB2

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 3 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 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
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 ACE 277/4885NTSR2 1758/4885NTSR1 906/4885

“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.