SCHEMBL30759335

SCHEMBL30759335

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

nearest known ligand 0.49

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ OPRM1 P35372 2/20 0.49
▸ OPRD1 P41143 2/20 0.49
▸ HDAC3 O15379 2/20 0.46
▸ HDAC4 P56524 2/20 0.46
▸ HDAC1 Q13547 2/20 0.46
▸ HDAC2 Q92769 2/20 0.46
▸ HDAC8 Q9BY41 2/20 0.46
▸ MMP2 P08253 14/20 0.44
▸ MMP1 P03956 9/20 0.44
▸ MMP3 P08254 9/20 0.44
▸ MME P08473 1/20 0.44
▸ ACE P12821 1/20 0.44
▸ CPA1 P15085 1/20 0.44
▸ ACE2 Q9BYF1 1/20 0.44
▸ MMP7 P09237 4/20 0.42

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
SCHEMBL30759489 0.95 OPRM1 (0.48) OPRM1OPRD1HDAC3HDAC4HDAC1
SCHEMBL30759468 0.89 OPRM1 (0.45) OPRM1OPRD1HDAC3HDAC4HDAC1
SCHEMBL30759345 0.86 KISS1R (0.44) OPRM1OPRD1MMP2MMP1
SCHEMBL8583007 0.81 MME (0.64) OPRM1OPRD1HDAC3HDAC4HDAC1
SCHEMBL30973624 0.81 MME (0.64) OPRM1OPRD1HDAC3HDAC4HDAC1
SCHEMBL9956195 0.81 MME (0.64) OPRM1OPRD1HDAC3HDAC4HDAC1
SCHEMBL30555017 0.78 MME (0.60) OPRM1OPRD1HDAC3HDAC4HDAC1
SCHEMBL29498151 0.78 BIRC2 (0.62) OPRM1OPRD1HDAC3HDAC4HDAC1
SCHEMBL30759473 0.77 MMP2 (0.43) HDAC3HDAC4HDAC1HDAC2HDAC8
SCHEMBL30411712 0.77 OPRK1 (0.42) OPRM1OPRD1

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 OPRM1 2520/4885OPRD1 2249/4885HDAC3 1660/4885

“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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