SCHEMBL29540337

SCHEMBL29540337

C[C@@H](O)[C@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](N)CS)[C@@H](C)O)[C@@H](C)O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CC(=O)O)C(=O)N1CCC[C@H]1C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)NCC(=O)NCC(=O)O

nearest known ligand 0.57

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ EPHA2 P29317 2/20 0.54
▸ IL23R Q5VWK5 1/20 0.54
▸ OPRD1 P41143 4/20 0.53
▸ OPRM1 P35372 2/20 0.53
▸ KEAP1 Q14145 2/20 0.52
▸ NMUR2 Q9GZQ4 1/20 0.52
▸ NMUR1 Q9HB89 1/20 0.52
▸ RAMP3 O60896 1/20 0.51
▸ CALCR P30988 1/20 0.51
▸ SLC6A2 P23975 1/20 0.51

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
SCHEMBL31707422 0.86 NMUR2 (0.59) IL23RKEAP1NMUR2NMUR1
SCHEMBL30607271 0.86 EP300 (0.58) KEAP1RAMP3CALCR
SCHEMBL30485544 0.86 NMUR2 (0.59) EPHA2KEAP1NMUR2NMUR1RAMP3
SCHEMBL29403705 0.86 IL23R (0.55) EPHA2IL23ROPRD1
SCHEMBL30605203 0.85 OPRD1 (0.52) IL23ROPRD1OPRM1NMUR2NMUR1
SCHEMBL30906428 0.85 EPHA2 (0.59) EPHA2IL23RRAMP3CALCR
SCHEMBL30571151 0.85 EPHA2 (0.58) EPHA2KEAP1RAMP3CALCR
SCHEMBL29865083 0.85 OPRM1 (0.62) EPHA2OPRD1OPRM1NMUR2NMUR1
SCHEMBL30063804 0.85 EPHA2 (0.58) EPHA2OPRD1OPRM1KEAP1NMUR2
SCHEMBL29865041 0.85 OPRM1 (0.62) EPHA2OPRD1OPRM1NMUR2NMUR1

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
US-12415835-B2 Peptide-compound cyclization method CHUGAI SEIYAKU KABUSHIKI KAISHA (JP) 2025-09-16 — — US disclosed
US-11891457-B2 Peptide-compound cyclization method CHUGAI SEIYAKU KABUSHIKI KAISHA (JP) 2024-02-06 — — US disclosed
EP-3974563-A1 CYCLIC PEPTIDES Chugai Seiyaku Kabushiki Kaisha (JP) 2022-03-30 — — EP 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 (2 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-11891457-B2 Peptide-compound cyclization method VIP, NGLY1, GLP1R EPHA2 4580/4885IL23R 3167/4885OPRD1 4574/4885
US-12415835-B2 Peptide-compound cyclization method VIP, NGLY1, GLP1R EPHA2 4580/4885IL23R 3167/4885OPRD1 4574/4885

“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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