SCHEMBL29557726

SCHEMBL29557726

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

nearest known ligand 0.55

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ BCHE P06276 1/20 0.55
▸ CYP2C19 P33261 1/20 0.54
▸ DPP3 Q9NY33 4/20 0.52
▸ DPP4 P27487 1/20 0.52
▸ CCKAR P32238 1/20 0.51
▸ CCKBR P32239 1/20 0.51
▸ OPRM1 P35372 1/20 0.49
▸ TSHR P16473 1/20 0.49
▸ ITGB2 P05107 2/20 0.48
▸ ICAM1 P05362 2/20 0.48
▸ ITGAL P20701 2/20 0.48
▸ ERAP2 Q6P179 1/20 0.48
▸ BRS3 P32247 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
SCHEMBL30478003 0.91 DPP3 (0.52) BCHECYP2C19DPP3DPP4CCKAR
SCHEMBL15692330 0.90 BCHE (0.63) BCHECYP2C19DPP3DPP4OPRM1
SCHEMBL30051339 0.88 DPP4 (0.58) BCHECYP2C19DPP3DPP4TSHR
SCHEMBL30051406 0.87 DPP3 (0.58) BCHECYP2C19DPP3DPP4ITGB2
SCHEMBL29966903 0.86 DPP4 (0.54) BCHECYP2C19DPP3DPP4CCKBR
SCHEMBL30051392 0.86 DPP3 (0.67) BCHECYP2C19DPP3DPP4
SCHEMBL29420134 0.86 DPP3 (0.57) BCHECYP2C19DPP3DPP4OPRM1
SCHEMBL30052289 0.86 DPP3 (0.59) BCHEDPP3DPP4
SCHEMBL21556145 0.86 DPP3 (0.49) BCHEDPP3DPP4CCKARCCKBR
SCHEMBL6879435 0.85 DPP3 (0.53) BCHEDPP3DPP4OPRM1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12622975-B2 Peptide-conjugated prodrugs BRANDEIS UNIVERSITY (US) 2026-05-12 — — US disclosed
EP-3515928-B1 UNSTRUCTURED NON-REPETITIVE POLYPEPTIDES HAVING LCST BEHAVIOR UNIV DUKE (US) 2026-01-28 — — EP disclosed
US-12084480-B2 Unstructured non-repetitive polypeptides having lcst behavior DUKE UNIVERSITY (US) 2024-09-10 — — US disclosed
US-20220387610-A1 PEPTIDE-CONJUGATED PRODRUGS NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2022-12-08 — — US disclosed
US-20220098248-A1 UNSTRUCTURED NON-REPETITIVE POLYPEPTIDES HAVING LCST BEHAVIOR DUKE UNIVERSITY 2022-03-31 — — US 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-12622975-B2 Peptide-conjugated prodrugs PEPD, PAM, VIP BCHE 353/4885CYP2C19 212/4885DPP3 25/4885
US-20220387610-A1 PEPTIDE-CONJUGATED PRODRUGS VIP, DNPEP, PEPD BCHE 231/4885CYP2C19 699/4885DPP3 64/4885

“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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