SCHEMBL30759348

SCHEMBL30759348

CCCC[C@@H](C(=O)N(C)F)N(C)OC(=O)[C@@H](N)CCC

nearest known ligand 0.36

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ SLC1A2 P43004 3/20 0.36
▸ SLC1A1 P43005 3/20 0.36
▸ SLC1A3 P43003 2/20 0.36
▸ DPP7 Q9UHL4 3/20 0.35
▸ DPP4 P27487 2/20 0.35
▸ DPP8 Q6V1X1 2/20 0.35
▸ DPP9 Q86TI2 2/20 0.35
▸ GRIK1 P39086 3/20 0.32
▸ GRIK2 Q13002 3/20 0.32
▸ SLC15A1 P46059 1/20 0.32
▸ CA1 P00915 1/20 0.31
▸ CA2 P00918 1/20 0.31

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
SCHEMBL30759521 0.90 SLC1A2 (0.35) SLC1A2SLC1A1SLC1A3DPP7GRIK1
SCHEMBL30759400 0.81 SLC7A5 (0.40) —
SCHEMBL30759453 0.75 SLC7A5 (0.42) CA1CA2
SCHEMBL30759342 0.73 DPP7 (0.46) SLC1A2SLC1A1SLC1A3DPP7DPP4
SCHEMBL31754346 0.73 SLC1A2 (0.39) SLC1A2SLC1A1SLC1A3DPP7DPP4
SCHEMBL16710358 0.65 ALDH1A1 (0.50) SLC1A2SLC1A1SLC1A3DPP7DPP4
SCHEMBL6445484 0.64 DPP7 (0.50) SLC1A2SLC1A1SLC1A3DPP7DPP4
SCHEMBL21114423 0.64 DPP7 (0.50) SLC1A2SLC1A1SLC1A3DPP7DPP4
SCHEMBL5497695 0.64 DPP7 (0.50) SLC1A2SLC1A1SLC1A3DPP7DPP4
SCHEMBL2785915 0.64 DPP7 (0.50) SLC1A2SLC1A1SLC1A3DPP7DPP4

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-20260001914-A1 MACROCYCLIC PEPTIDES TARGETING KRAS MERCK SHARP & DOHME LLC (US) 2026-01-01 — — US disclosed
EP-4558513-A1 MACROCYCLIC PEPTIDES TARGETING KRAS Merck Sharp & Dohme LLC (US) 2025-05-28 — — EP disclosed
WO-2024020159-A1 MACROCYCLIC PEPTIDES TARGETING KRAS MERCK SHARP & DOHME LLC (US) 2024-01-25 — — WO 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 (1 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-20260001914-A1 MACROCYCLIC PEPTIDES TARGETING KRAS KRAS, NRAS, HRAS SLC1A2 4093/4885SLC1A1 2783/4885SLC1A3 2477/4885

“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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