SCHEMBL30759512

SCHEMBL30759512

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

nearest known ligand 0.43

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ KISS1R Q969F8 5/20 0.41
▸ OPRK1 P41145 3/20 0.39
▸ SSTR3 P32745 1/20 0.39
▸ PSMB5 P28074 1/20 0.38
▸ PSMB2 P49721 1/20 0.38
▸ REN P00797 1/20 0.38
▸ OPRM1 P35372 2/20 0.37
▸ OPRD1 P41143 2/20 0.37
▸ GHSR Q92847 1/20 0.36

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 0.86 KISS1R (0.44) KISS1RRENOPRM1OPRD1
SCHEMBL30759389 0.82 KISS1R (0.42) KISS1RRENOPRM1OPRD1
SCHEMBL30759554 0.80 KISS1R (0.41) KISS1RRENOPRM1OPRD1
SCHEMBL30759439 0.79 KISS1R (0.41) KISS1RRENOPRM1OPRD1
SCHEMBL31754278 0.78 KISS1R (0.39) KISS1RSSTR3RENOPRM1OPRD1
SCHEMBL30759443 0.76 KISS1R (0.45) KISS1RPSMB5PSMB2REN
SCHEMBL30759527 0.74 OPRM1 (0.39) KISS1ROPRM1OPRD1
SCHEMBL30973680 0.73 GNPAT (0.59) OPRK1SSTR3RENOPRM1OPRD1
SCHEMBL31167351 0.73 ERAP2 (0.51) KISS1ROPRK1
SCHEMBL31181188 0.73 GNPAT (0.59) OPRK1SSTR3RENOPRM1OPRD1

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 2731/4885OPRK1 3317/4885SSTR3 98/4885

“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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