SCHEMBL29540462

SCHEMBL29540462

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

nearest known ligand 0.50

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ CAPN1 P07384 2/20 0.50
▸ CTSB P07858 2/20 0.50
▸ DPP3 Q9NY33 2/20 0.50
▸ BCHE P06276 1/20 0.50
▸ GHSR Q92847 1/20 0.50
▸ PIN1 Q13526 1/20 0.49
▸ BCL2A1 Q16548 2/20 0.49
▸ BID P55957 1/20 0.49
▸ CCKBR P32239 8/20 0.48
▸ KISS1R Q969F8 2/20 0.48
▸ TACR1 P25103 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
SCHEMBL29540032 0.85 BCL2A1 (0.54) CAPN1CTSBDPP3BCL2A1BID
SCHEMBL30310982 0.82 CCKBR (0.61) DPP3BCHEGHSRCCKBR
SCHEMBL13226652 0.81 CAPN1 (0.54) CAPN1CTSBDPP3CCKBRKISS1R
SCHEMBL12890377 0.80 TACR1 (0.51) CAPN1CTSBDPP3BCHEGHSR
SCHEMBL30310882 0.80 CCKBR (0.61) DPP3CCKBR
SCHEMBL29539999 0.79 BCL2A1 (0.71) BCL2A1BIDTACR1
SCHEMBL24245857 0.79 DPP3 (0.54) CAPN1CTSBDPP3BCHEGHSR
SCHEMBL23380930 0.79 GHSR (0.57) DPP3GHSRCCKBR
SCHEMBL29454483 0.79 DPP3 (0.57) CAPN1CTSBDPP3
SCHEMBL29454493 0.79 DPP3 (0.57) CAPN1CTSBDPP3

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 CAPN1 1338/4885CTSB 159/4885DPP3 88/4885
US-12415835-B2 Peptide-compound cyclization method VIP, NGLY1, GLP1R CAPN1 1338/4885CTSB 159/4885DPP3 88/4885

“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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