SCHEMBL29540596

SCHEMBL29540596

CC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CSSC(C)(C)C)C(=O)N1CCC[C@H]1C(=O)O

nearest known ligand 0.48

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ CCKBR P32239 13/20 0.48
▸ DPP3 Q9NY33 2/20 0.48
▸ BCHE P06276 1/20 0.48
▸ CYP2C19 P33261 1/20 0.47

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
SCHEMBL29540331 1.00 CCKBR (0.48) CCKBRDPP3BCHECYP2C19
SCHEMBL16310638 0.91 CCKBR (0.48) CCKBRBCHE
SCHEMBL16288756 0.88 DPP3 (0.46) CCKBRDPP3BCHE
SCHEMBL15083480 0.88 DPP3 (0.46) CCKBRDPP3BCHE
SCHEMBL31683972 0.88 DPP3 (0.46) CCKBRDPP3BCHE
SCHEMBL23140697 0.88 DPP3 (0.46) CCKBRDPP3BCHE
SCHEMBL15083530 0.88 DPP3 (0.46) CCKBRDPP3BCHE
SCHEMBL31683977 0.88 DPP3 (0.46) CCKBRDPP3BCHE
SCHEMBL16288960 0.87 DPP3 (0.45) CCKBRDPP3
SCHEMBL16289747 0.87 DPP3 (0.45) CCKBRDPP3BCHE

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 CCKBR 19/4885DPP3 88/4885BCHE 1524/4885
US-12415835-B2 Peptide-compound cyclization method VIP, NGLY1, GLP1R CCKBR 19/4885DPP3 88/4885BCHE 1524/4885

“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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