SCHEMBL30759389

SCHEMBL30759389

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

nearest known ligand 0.42

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ KISS1R Q969F8 3/20 0.42
▸ REN P00797 1/20 0.40
▸ MMP12 P39900 1/20 0.39
▸ OPRD1 P41143 3/20 0.39
▸ OPRM1 P35372 2/20 0.39
▸ MMP2 P08253 9/20 0.39
▸ MMP1 P03956 4/20 0.39
▸ MMP3 P08254 4/20 0.39
▸ CTSL P07711 1/20 0.38
▸ CTSB P07858 1/20 0.38
▸ GNPAT O15228 1/20 0.38

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
SCHEMBL30759345 0.91 KISS1R (0.44) KISS1RRENMMP12OPRD1OPRM1
SCHEMBL30759554 0.91 KISS1R (0.41) KISS1RRENMMP12OPRD1OPRM1
SCHEMBL31754278 0.89 KISS1R (0.39) KISS1RRENOPRD1OPRM1MMP2
SCHEMBL30759439 0.88 KISS1R (0.41) KISS1RRENMMP12OPRD1OPRM1
SCHEMBL30759468 0.87 OPRM1 (0.45) OPRD1OPRM1MMP2MMP1MMP3
SCHEMBL30759443 0.86 KISS1R (0.45) KISS1RREN
SCHEMBL30759397 0.86 REN (0.40) RENOPRD1OPRM1MMP2MMP1
SCHEMBL30759527 0.85 OPRM1 (0.39) KISS1RMMP12OPRD1OPRM1MMP2
SCHEMBL30759473 0.83 MMP2 (0.43) MMP2MMP1MMP3GNPAT
SCHEMBL31754333 0.83 LONP1 (0.38) MMP12MMP2MMP1MMP3CTSL

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 KISS1R 2731/4885REN 186/4885MMP12 3315/4885

“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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