SCHEMBL31146384

SCHEMBL31146384

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

nearest known ligand 0.39

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ ACE P12821 2/20 0.39
▸ REN P00797 2/20 0.39
▸ ITGB3 P05106 1/20 0.38
▸ ITGA2B P08514 1/20 0.38
▸ F2 P00734 7/20 0.38
▸ F10 P00742 2/20 0.38
▸ KMT2A Q03164 1/20 0.37
▸ OPRM1 P35372 1/20 0.36
▸ XIAP P98170 1/20 0.35
▸ PRSS1 P07477 1/20 0.35
▸ PRSS2 P07478 1/20 0.35
▸ PRSS3 P35030 1/20 0.35
▸ CHRM2 P08172 1/20 0.35
▸ CHRM4 P08173 1/20 0.35
▸ CHRM5 P08912 1/20 0.35
▸ CHRM1 P11229 1/20 0.35
▸ CHRM3 P20309 1/20 0.35
▸ BDKRB2 P30411 1/20 0.35
▸ TMPRSS11D O60235 1/20 0.35

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
SCHEMBL29407980 0.87 CAPN1 (0.43) F2F10OPRM1BDKRB2
SCHEMBL29541526 0.84 ITGB3 (0.40) ACERENITGB3ITGA2BF2
SCHEMBL29567754 0.83 ELANE (0.48) ACEITGB3ITGA2BXIAP
SCHEMBL1402279 0.83 CHRM2 (0.42) ACEF2PRSS1CHRM2CHRM4
SCHEMBL1402277 0.83 CHRM2 (0.42) ACEF2PRSS1CHRM2CHRM4
SCHEMBL29388785 0.83 ACE (0.45) ACERENITGB3ITGA2BF2
SCHEMBL21581703 0.81 CAPN1 (0.45) F2OPRM1BDKRB2
SCHEMBL26454162 0.81 CAPN1 (0.45) F2OPRM1BDKRB2
SCHEMBL29666480 0.81 ACE (0.57) ACERENF2
SCHEMBL29349875 0.80 DPP4 (0.43) ACEF2KMT2APRSS1CHRM2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20250042946-A1 Biological Production of Histidine-Rich Peptides OAKGROVE BIO LLC (US) 2025-02-06 — — US disclosed
EP-4444739-A2 BIOLOGICAL PRODUCTION OF HISTIDINE-RICH PEPTIDES Oakgrove Bio LLC (US) 2024-10-16 — — EP disclosed
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