SCHEMBL25179592

SCHEMBL25179592

COC(=O)N(C1c2ccccc2-c2ccccc21)[C@@H](Cc1cccc(I)c1F)C(=O)O

nearest known ligand 0.31

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ PPIA P62937 2/20 0.31
▸ CYP2D6 P10635 1/20 0.31
▸ SLC6A2 P23975 1/20 0.31
▸ SLC6A4 P31645 1/20 0.31
▸ SLC6A3 Q01959 1/20 0.31
▸ PPARG P37231 1/20 0.31
▸ PPARA Q07869 1/20 0.31
▸ CYP1A2 P05177 1/20 0.30
▸ TSHR P16473 1/20 0.30

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
SCHEMBL30510418 0.90 PPIA (0.37) PPIACYP2D6SLC6A2SLC6A4SLC6A3
SCHEMBL30510414 0.88 PPARG (0.33) PPIACYP2D6SLC6A2SLC6A4SLC6A3
SCHEMBL27078234 0.88 PPARG (0.33) PPIACYP2D6SLC6A2SLC6A4SLC6A3
SCHEMBL25186515 0.86 PPIA (0.41) PPIACYP2D6SLC6A2SLC6A4SLC6A3
SCHEMBL27215385 0.86 PPIA (0.41) PPIACYP2D6SLC6A2SLC6A4SLC6A3
SCHEMBL25182298 0.83 PPIA (0.33) PPIAPPARGPPARACYP1A2TSHR
SCHEMBL25179578 0.83 PPARG (0.39) CYP2D6SLC6A2SLC6A4SLC6A3PPARG
SCHEMBL30767804 0.83 PPARG (0.39) CYP2D6SLC6A2SLC6A4SLC6A3PPARG
SCHEMBL15240994 0.82 CTNNB1 (0.41) —
SCHEMBL25178701 0.82 PPIA (0.34) PPIAPPARGPPARACYP1A2TSHR

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12371454-B2 Cyclic peptide compound having Kras inhibitory action CHUGAI SEIYAKU KABUSHIKI KAISHA (JP) 2025-07-29 — — US disclosed
US-20240400617-A1 CYCLIC PEPTIDE COMPOUND HAVING KRAS INHIBITORY ACTION CHUGAI SEIYAKU KABUSHIKI KAISHA (JP) 2024-12-05 — — US disclosed
US-20230151060-A1 CYCLIC PEPTIDE COMPOUND HAVING KRAS INHIBITORY ACTION CHUGAI SEIYAKU KABUSHIKI KAISHA (JP) 2023-05-18 — — US disclosed
WO-2022234852-A1 PHARMACEUTICAL USE OF CYCLIC PEPTIDE COMPOUND 中外製薬株式会社 2022-11-10 — — 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 (3 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-20230151060-A1 CYCLIC PEPTIDE COMPOUND HAVING KRAS INHIBITORY ACTION KRAS, NRAS, HRAS PPIA 749/4885CYP2D6 4576/4885SLC6A2 4519/4885
US-20240400617-A1 CYCLIC PEPTIDE COMPOUND HAVING KRAS INHIBITORY ACTION KRAS, NRAS, HRAS PPIA 749/4885CYP2D6 4576/4885SLC6A2 4519/4885
US-12371454-B2 Cyclic peptide compound having Kras inhibitory action KRAS, NRAS, HRAS PPIA 749/4885CYP2D6 4576/4885SLC6A2 4519/4885

“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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