SCHEMBL30759475

SCHEMBL30759475

CCCC[C@](F)(NC(=O)[C@@H](N)Cc1cccnc1)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@](F)(CCCC)C(=O)N(C)[C@@H](Cc1cccnc1)C(=O)O

nearest known ligand 0.35

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ PLG P00747 1/20 0.35
▸ KLKB1 P03952 1/20 0.34
▸ OPRM1 P35372 2/20 0.34
▸ OPRD1 P41143 2/20 0.34
▸ MMP12 P39900 2/20 0.34
▸ MMP9 P14780 1/20 0.34
▸ MMP8 P22894 1/20 0.34
▸ KISS1R Q969F8 1/20 0.34
▸ CTSL P07711 2/20 0.33
▸ GPR132 Q9UNW8 1/20 0.33
▸ LMNA P02545 1/20 0.33
▸ CTSB P07858 1/20 0.33
▸ CYP3A4 P08684 1/20 0.33
▸ MMP2 P08253 4/20 0.33
▸ MMP1 P03956 2/20 0.33

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
SCHEMBL30759393 0.93 LMNA (0.38) LMNACYP3A4
SCHEMBL30759554 0.91 KISS1R (0.41) KLKB1OPRM1OPRD1MMP12KISS1R
SCHEMBL30759527 0.90 OPRM1 (0.39) KLKB1OPRM1OPRD1MMP12MMP9
SCHEMBL30759439 0.88 KISS1R (0.41) KLKB1OPRM1OPRD1MMP12KISS1R
SCHEMBL31754333 0.85 LONP1 (0.38) MMP12CTSLCTSBMMP2MMP1
SCHEMBL31754278 0.85 KISS1R (0.39) OPRM1OPRD1KISS1RCTSLCTSB
SCHEMBL30759550 0.85 LONP1 (0.34) KLKB1OPRM1OPRD1MMP12KISS1R
SCHEMBL30759495 0.84 MMP12 (0.38) MMP12CTSLCTSBMMP2MMP1
SCHEMBL30759443 0.83 KISS1R (0.45) KISS1R
SCHEMBL30759510 0.83 MMP12 (0.37) MMP12CTSLCTSBMMP2MMP1

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 PLG 4406/4885KLKB1 4259/4885OPRM1 2520/4885

“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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